Mercurial > repos > bgruening > padel
annotate test-data/test.sdf @ 1:a84bcb007b09 draft default tip
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit 7fb96a3844b4771084f18de2346ed6d5e241d839"
author | bgruening |
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date | Sat, 25 Sep 2021 19:07:19 +0000 |
parents | 30c673b5b061 |
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rev | line source |
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0
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
1 NCGC00261443 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
2 Marvin 10161415332D |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
3 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
4 20 22 0 0 1 0 999 V2000 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
5 0.5185 2.9762 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
6 1.2330 2.5637 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
7 1.2330 1.7387 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
8 0.5185 1.3262 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
9 -0.2661 1.5812 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
10 -0.7510 0.9137 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
11 -0.2661 0.2463 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
12 -0.5210 -0.5383 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
13 -1.3056 -0.7933 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
14 -1.3056 -1.6183 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
15 -1.9731 -2.1032 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
16 -2.7268 -1.7676 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
17 -0.5210 -1.8732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
18 -0.2661 -2.6578 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
19 -0.0361 -1.2058 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
20 0.7889 -1.2058 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
21 0.5185 0.5012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
22 1.2330 0.0887 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
23 1.9475 0.5012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
24 1.9475 1.3262 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
25 1 2 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
26 2 3 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
27 3 4 2 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
28 4 5 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
29 5 6 2 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
30 6 7 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
31 7 8 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
32 8 9 1 1 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
33 9 10 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
34 10 11 1 1 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
35 11 12 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
36 10 13 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
37 13 14 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
38 13 15 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
39 8 15 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
40 15 16 1 6 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
41 7 17 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
42 4 17 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
43 17 18 2 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
44 18 19 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
45 19 20 2 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
46 3 20 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
47 M END |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
48 > <Compound ID> |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
49 NCGC00261443 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
50 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
51 > <Compound Batch ID> |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
52 NCGC00261443-01 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
53 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
54 > <NR-AR> |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
55 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
56 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
57 > <NR-AR-LBD> |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
58 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
59 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
60 > <NR-AhR> |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
61 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
62 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
63 > <NR-ER> |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
64 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
65 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
66 > <NR-ER-LBD> |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
67 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
68 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
69 > <NR-PPAR-gamma> |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
70 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
71 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
72 > <SR-ARE> |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
73 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
74 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
75 > <SR-ATAD5> |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
76 1 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
77 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
78 > <SR-HSE> |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
79 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
80 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
81 > <SR-MMP> |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
82 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
83 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
84 > <SR-p53> |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
85 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
86 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
87 $$$$ |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
88 NCGC00261600 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
89 Marvin 10161415332D |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
90 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
91 18 19 0 0 0 0 999 V2000 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
92 -1.7862 -2.3604 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
93 -1.7862 -1.5354 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
94 -1.0717 -1.1229 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
95 -1.0717 -0.2979 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
96 -0.3572 0.1146 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
97 0.3572 -0.2979 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
98 1.0717 0.1146 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
99 1.7862 -0.2979 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
100 2.5006 0.1146 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
101 2.5006 0.9396 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
102 3.2151 1.3521 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
103 1.7862 1.3521 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
104 1.7862 2.1771 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
105 1.0717 0.9396 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
106 -1.7862 0.1146 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
107 -2.5006 -0.2979 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
108 -3.2151 0.1146 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
109 -2.5006 -1.1229 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
110 1 2 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
111 2 3 2 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
112 3 4 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
113 4 5 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
114 5 6 2 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
115 6 7 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
116 7 8 2 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
117 8 9 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
118 9 10 2 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
119 10 11 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
120 10 12 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
121 12 13 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
122 12 14 2 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
123 7 14 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
124 4 15 2 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
125 15 16 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
126 16 17 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
127 16 18 2 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
128 2 18 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
129 M END |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
130 > <Compound ID> |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
131 NCGC00261600 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
132 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
133 > <Compound Batch ID> |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
134 NCGC00261600-01 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
135 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
136 > <NR-AR> |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
137 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
138 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
139 > <NR-AR-LBD> |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
140 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
141 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
142 > <NR-ER> |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
143 1 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
144 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
145 > <NR-PPAR-gamma> |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
146 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
147 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
148 > <SR-ATAD5> |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
149 1 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
150 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
151 > <SR-p53> |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
152 1 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
153 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
154 $$$$ |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
155 NCGC00260926 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
156 Marvin 10161415332D |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
157 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
158 27 30 0 0 0 0 999 V2000 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
159 0.0000 0.0000 0.0000 Cl 0 5 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
160 9.3498 -0.7615 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
161 8.6353 -1.1740 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
162 7.9208 -0.7615 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
163 7.9208 0.0635 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
164 7.2064 0.4760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
165 6.4919 0.0635 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
166 5.7774 0.4760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
167 5.7774 1.3010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
168 5.0630 1.7135 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
169 4.3485 1.3010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
170 3.6340 1.7135 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
171 2.9195 1.3010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
172 2.1349 1.5559 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
173 1.6500 0.8885 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
174 2.1349 0.2210 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
175 2.9195 0.4760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
176 3.6340 0.0635 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
177 4.3485 0.4760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
178 5.0630 0.0635 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
179 5.0630 -0.7615 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
180 4.3485 -1.1740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
181 5.7774 -1.1740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
182 6.4919 -0.7615 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
183 7.2064 -1.1740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
184 7.2064 -1.9990 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
185 6.4919 -2.4115 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
186 2 3 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
187 3 4 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
188 4 5 2 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
189 5 6 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
190 6 7 2 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
191 7 8 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
192 8 9 2 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
193 9 10 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
194 10 11 2 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
195 11 12 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
196 12 13 2 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
197 13 14 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
198 14 15 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
199 15 16 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
200 16 17 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
201 13 17 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
202 17 18 2 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
203 18 19 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
204 11 19 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
205 19 20 2 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
206 8 20 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
207 20 21 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
208 21 22 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
209 21 23 2 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
210 23 24 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
211 7 24 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
212 24 25 2 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
213 4 25 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
214 25 26 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
215 26 27 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
216 M CHG 2 1 -1 21 1 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
217 M END |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
218 > <Compound ID> |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
219 NCGC00260926 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
220 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
221 > <Compound Batch ID> |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
222 NCGC00260926-01 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
223 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
224 > <NR-AR> |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
225 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
226 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
227 > <NR-AhR> |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
228 1 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
229 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
230 > <NR-ER> |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
231 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
232 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
233 > <SR-ARE> |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
234 1 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
235 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
236 > <SR-HSE> |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
237 1 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
238 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
239 > <SR-p53> |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
240 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
241 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
242 $$$$ |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
243 NCGC00261266 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
244 Marvin 10161415332D |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
245 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
246 14 13 0 0 0 0 999 V2000 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
247 0.0000 0.0000 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
248 4.1074 1.3050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
249 4.6618 0.6940 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
250 4.4933 -0.1136 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
251 3.7410 -0.4520 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
252 3.0717 0.0304 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
253 3.1548 0.8512 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
254 2.3193 -0.3081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
255 2.2362 -1.1289 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
256 1.6500 0.1743 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
257 5.2094 -0.5233 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
258 5.2988 -1.3435 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
259 5.8204 0.0310 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
260 5.4819 0.7834 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
261 2 3 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
262 3 4 2 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
263 4 5 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
264 5 6 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
265 6 7 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
266 6 8 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
267 8 9 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
268 8 10 2 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
269 4 11 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
270 11 12 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
271 11 13 2 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
272 13 14 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
273 3 14 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
274 M END |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
275 > <Compound ID> |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
276 NCGC00261266 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
277 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
278 > <Compound Batch ID> |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
279 NCGC00261266-01 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
280 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
281 > <NR-AR> |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
282 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
283 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
284 > <NR-AR-LBD> |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
285 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
286 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
287 > <NR-AhR> |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
288 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
289 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
290 > <NR-Aromatase> |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
291 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
292 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
293 > <NR-ER> |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
294 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
295 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
296 > <NR-ER-LBD> |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
297 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
298 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
299 > <NR-PPAR-gamma> |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
300 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
301 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
302 > <SR-ARE> |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
303 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
304 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
305 > <SR-ATAD5> |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
306 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
307 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
308 > <SR-HSE> |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
309 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
310 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
311 > <SR-MMP> |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
312 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
313 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
314 > <SR-p53> |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
315 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
316 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
317 $$$$ |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
318 NCGC00261897 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
319 Marvin 10161415332D |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
320 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
321 18 19 0 0 0 0 999 V2000 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
322 0.9923 -2.7729 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
323 0.9923 -1.9479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
324 1.7068 -1.5354 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
325 1.7068 -0.7104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
326 2.4213 -0.2979 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
327 0.9923 -0.2979 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
328 0.9923 0.5271 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
329 1.7068 0.9396 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
330 0.2778 -0.7104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
331 -0.4366 -0.2979 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
332 -0.4366 0.5271 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
333 -1.1511 0.9396 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
334 -1.1511 1.7646 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
335 -1.8656 2.1771 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
336 -2.5800 1.7646 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
337 -2.5800 0.9396 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
338 -1.8656 0.5271 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
339 0.2778 -1.5354 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
340 1 2 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
341 2 3 2 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
342 3 4 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
343 4 5 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
344 4 6 2 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
345 6 7 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
346 7 8 2 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
347 6 9 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
348 9 10 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
349 10 11 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
350 11 12 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
351 12 13 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
352 13 14 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
353 14 15 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
354 15 16 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
355 16 17 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
356 12 17 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
357 9 18 2 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
358 2 18 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
359 M END |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
360 > <Compound ID> |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
361 NCGC00261897 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
362 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
363 > <Compound Batch ID> |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
364 NCGC00261897-01 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
365 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
366 > <NR-AR> |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
367 1 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
368 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
369 > <NR-AR-LBD> |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
370 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
371 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
372 > <NR-AhR> |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
373 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
374 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
375 > <NR-Aromatase> |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
376 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
377 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
378 > <NR-ER-LBD> |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
379 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
380 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
381 > <NR-PPAR-gamma> |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
382 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
383 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
384 > <SR-ARE> |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
385 1 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
386 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
387 > <SR-ATAD5> |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
388 1 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
389 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
390 > <SR-HSE> |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
391 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
392 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
393 > <SR-p53> |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
394 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
395 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
396 $$$$ |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
397 NCGC00261559 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
398 Marvin 10161415332D |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
399 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
400 25 29 0 0 0 0 999 V2000 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
401 -2.0160 -0.9532 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
402 -1.5310 -0.2858 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
403 -2.0160 0.3817 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
404 -2.8006 0.1267 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
405 -2.8006 -0.6983 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
406 -3.5151 -1.1108 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
407 -4.2295 -0.6983 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
408 -4.2295 0.1267 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
409 -3.5151 0.5392 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
410 -0.7060 -0.2858 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
411 -0.2935 -1.0003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
412 0.5315 -1.0003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
413 0.9440 -0.2858 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
414 0.5315 0.4287 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
415 -0.2935 0.4287 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
416 1.7690 -0.2858 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
417 2.1815 -1.0003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
418 3.0065 -1.0003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
419 3.4190 -0.2858 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
420 3.0065 0.4287 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
421 2.1815 0.4287 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
422 1.7690 1.1432 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
423 2.1815 1.8576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
424 3.0065 1.8576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
425 3.4190 1.1432 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
426 1 2 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
427 2 3 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
428 3 4 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
429 4 5 2 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
430 1 5 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
431 5 6 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
432 6 7 2 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
433 7 8 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
434 8 9 2 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
435 4 9 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
436 2 10 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
437 10 11 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
438 11 12 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
439 12 13 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
440 13 14 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
441 14 15 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
442 10 15 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
443 13 16 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
444 16 17 2 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
445 17 18 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
446 18 19 2 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
447 19 20 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
448 20 21 2 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
449 16 21 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
450 21 22 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
451 22 23 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
452 23 24 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
453 24 25 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
454 20 25 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
455 M END |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
456 > <Compound ID> |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
457 NCGC00261559 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
458 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
459 > <Compound Batch ID> |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
460 NCGC00261559-01 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
461 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
462 > <NR-AR> |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
463 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
464 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
465 > <NR-AR-LBD> |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
466 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
467 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
468 > <NR-AhR> |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
469 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
470 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
471 > <NR-Aromatase> |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
472 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
473 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
474 > <NR-ER> |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
475 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
476 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
477 > <NR-ER-LBD> |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
478 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
479 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
480 > <NR-PPAR-gamma> |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
481 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
482 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
483 > <SR-ARE> |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
484 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
485 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
486 > <SR-ATAD5> |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
487 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
488 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
489 > <SR-HSE> |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
490 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
491 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
492 > <SR-MMP> |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
493 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
494 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
495 > <SR-p53> |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
496 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
497 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
498 $$$$ |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
499 NCGC00261121 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
500 Marvin 10161415332D |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
501 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
502 20 21 0 0 0 0 999 V2000 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
503 0.0000 0.0000 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
504 5.6007 1.6257 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
505 4.8862 1.2132 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
506 4.1718 1.6257 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
507 3.4573 1.2132 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
508 3.4573 0.3882 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
509 4.1718 -0.0243 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
510 4.8862 0.3882 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
511 5.6007 -0.0243 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
512 2.8123 -0.1262 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
513 2.0080 0.0574 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
514 1.6500 0.8007 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
515 2.0080 1.5440 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
516 2.8123 1.7276 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
517 2.9958 -0.9305 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
518 2.3911 -1.4916 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
519 2.5747 -2.2960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
520 3.3630 -2.5391 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
521 3.9678 -1.9780 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
522 3.7842 -1.1737 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
523 2 3 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
524 3 4 2 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
525 4 5 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
526 5 6 2 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
527 6 7 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
528 7 8 2 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
529 3 8 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
530 8 9 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
531 6 10 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
532 10 11 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
533 11 12 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
534 12 13 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
535 13 14 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
536 5 14 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
537 10 15 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
538 15 16 2 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
539 16 17 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
540 17 18 2 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
541 18 19 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
542 19 20 2 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
543 15 20 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
544 M END |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
545 > <Compound ID> |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
546 NCGC00261121 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
547 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
548 > <Compound Batch ID> |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
549 NCGC00261121-01 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
550 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
551 > <NR-AR> |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
552 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
553 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
554 > <NR-AR-LBD> |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
555 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
556 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
557 > <NR-AhR> |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
558 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
559 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
560 > <NR-ER> |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
561 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
562 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
563 > <NR-ER-LBD> |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
564 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
565 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
566 > <NR-PPAR-gamma> |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
567 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
568 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
569 > <SR-ARE> |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
570 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
571 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
572 > <SR-ATAD5> |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
573 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
574 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
575 > <SR-HSE> |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
576 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
577 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
578 > <SR-MMP> |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
579 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
580 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
581 > <SR-p53> |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
582 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
583 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
584 $$$$ |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
585 NCGC00261374 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
586 Marvin 10161415332D |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
587 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
588 15 14 0 0 0 0 999 V2000 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
589 0.0000 0.0000 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
590 1.6500 -2.3866 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
591 2.3645 -1.9741 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
592 3.0789 -2.3866 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
593 2.3645 -1.1491 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
594 3.0789 -0.7366 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
595 3.0789 0.0884 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
596 2.3645 0.5009 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
597 2.3645 1.3259 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
598 3.0789 1.7384 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
599 2.6664 2.4529 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
600 3.4914 1.0239 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
601 3.7934 2.1509 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
602 1.6500 0.0884 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
603 1.6500 -0.7366 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
604 2 3 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
605 3 4 2 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
606 3 5 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
607 5 6 2 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
608 6 7 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
609 7 8 2 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
610 8 9 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
611 9 10 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
612 10 11 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
613 10 12 2 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
614 10 13 2 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
615 8 14 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
616 14 15 2 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
617 5 15 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
618 M END |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
619 > <Compound ID> |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
620 NCGC00261374 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
621 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
622 > <Compound Batch ID> |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
623 NCGC00261374-01 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
624 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
625 > <NR-AR> |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
626 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
627 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
628 > <NR-AR-LBD> |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
629 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
630 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
631 > <NR-AhR> |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
632 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
633 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
634 > <NR-Aromatase> |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
635 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
636 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
637 > <NR-ER> |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
638 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
639 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
640 > <NR-ER-LBD> |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
641 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
642 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
643 > <NR-PPAR-gamma> |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
644 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
645 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
646 > <SR-ARE> |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
647 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
648 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
649 > <SR-ATAD5> |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
650 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
651 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
652 > <SR-HSE> |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
653 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
654 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
655 > <SR-MMP> |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
656 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
657 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
658 > <SR-p53> |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
659 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
660 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
661 $$$$ |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
662 NCGC00261612 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
663 Marvin 10161415332D |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
664 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
665 24 25 0 0 0 0 999 V2000 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
666 0.0000 0.0000 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
667 3.5133 -0.3785 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
668 3.8701 0.3654 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
669 4.6927 0.4284 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
670 5.1585 -0.2525 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
671 5.9811 -0.1896 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
672 6.4469 -0.8705 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
673 6.0902 -1.6143 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
674 6.5560 -2.2952 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
675 7.3786 -2.2323 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
676 7.7354 -1.4884 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
677 7.2695 -0.8075 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
678 3.4043 1.0463 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
679 4.1187 1.4588 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
680 4.1187 2.2838 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
681 3.4043 2.6963 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
682 2.6898 2.2838 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
683 2.6898 1.4588 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
684 2.9384 0.3654 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
685 2.1158 0.4284 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
686 1.6500 -0.2525 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
687 2.0068 -0.9964 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
688 2.8294 -1.0594 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
689 3.2952 -0.3785 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
690 2 3 2 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
691 3 4 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
692 4 5 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
693 5 6 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
694 6 7 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
695 7 8 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
696 8 9 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
697 9 10 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
698 10 11 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
699 11 12 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
700 7 12 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
701 3 13 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
702 13 14 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
703 14 15 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
704 15 16 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
705 16 17 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
706 17 18 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
707 13 18 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
708 13 19 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
709 19 20 2 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
710 20 21 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
711 21 22 2 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
712 22 23 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
713 23 24 2 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
714 19 24 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
715 M END |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
716 > <Compound ID> |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
717 NCGC00261612 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
718 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
719 > <Compound Batch ID> |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
720 NCGC00261612-01 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
721 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
722 > <NR-AR> |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
723 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
724 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
725 > <NR-AR-LBD> |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
726 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
727 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
728 > <NR-AhR> |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
729 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
730 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
731 > <NR-Aromatase> |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
732 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
733 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
734 > <NR-ER> |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
735 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
736 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
737 > <NR-ER-LBD> |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
738 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
739 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
740 > <NR-PPAR-gamma> |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
741 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
742 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
743 > <SR-ARE> |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
744 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
745 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
746 > <SR-ATAD5> |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
747 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
748 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
749 > <SR-HSE> |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
750 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
751 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
752 > <SR-MMP> |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
753 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
754 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
755 > <SR-p53> |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
756 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
757 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
758 $$$$ |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
759 NCGC00261002 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
760 Marvin 10161415332D |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
761 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
762 38 42 0 0 1 0 999 V2000 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
763 2.4714 0.4876 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
764 1.6464 0.4876 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
765 1.2339 -0.2269 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
766 0.8214 0.4876 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
767 -0.0036 0.4876 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
768 -0.4161 -0.2269 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
769 -1.2411 -0.2269 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
770 -0.0036 -0.9414 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
771 -0.4161 -1.6558 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
772 -1.2411 -1.6558 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
773 -1.7261 -0.9884 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
774 -2.5107 -1.2433 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
775 -2.5107 -2.0683 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
776 -1.7261 -2.3233 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
777 -3.2251 -2.4808 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
778 -3.9396 -2.0683 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
779 -3.9396 -1.2433 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
780 -4.6541 -0.8308 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
781 -5.3686 -1.2433 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
782 -3.2251 -0.8308 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
783 -3.2251 -0.0058 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
784 -2.5107 0.4067 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
785 -3.9396 0.4067 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
786 0.8214 -0.9414 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
787 1.6464 -0.9414 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
788 1.2339 -1.6558 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
789 2.4714 -0.9414 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
790 2.8839 -0.2269 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
791 3.7089 -0.2269 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
792 2.8839 1.2020 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
793 3.7089 1.2020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
794 2.4714 1.9165 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
795 1.6464 1.9165 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
796 2.8839 2.6310 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
797 3.7043 2.7172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
798 3.8759 3.5242 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
799 3.1614 3.9367 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
800 2.5483 3.3847 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
801 1 2 1 6 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
802 3 2 1 1 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
803 3 4 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
804 4 5 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
805 5 6 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
806 6 7 1 6 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
807 6 8 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
808 8 9 1 6 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
809 9 10 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
810 10 11 2 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
811 11 12 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
812 12 13 2 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
813 13 14 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
814 10 14 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
815 13 15 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
816 15 16 2 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
817 16 17 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
818 17 18 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
819 18 19 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
820 17 20 2 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
821 12 20 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
822 20 21 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
823 21 22 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
824 21 23 2 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
825 8 24 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
826 3 24 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
827 3 25 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
828 25 26 1 1 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
829 25 27 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
830 27 28 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
831 1 28 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
832 28 29 1 6 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
833 1 30 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
834 30 31 1 1 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
835 30 32 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
836 32 33 2 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
837 32 34 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
838 34 35 2 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
839 35 36 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
840 36 37 2 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
841 37 38 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
842 34 38 1 0 0 0 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
843 M END |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
844 > <Compound ID> |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
845 NCGC00261002 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
846 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
847 > <Compound Batch ID> |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
848 NCGC00261002-01 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
849 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
850 > <NR-AR> |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
851 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
852 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
853 > <NR-AR-LBD> |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
854 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
855 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
856 > <NR-ER-LBD> |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
857 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
858 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
859 > <SR-ARE> |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
860 1 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
861 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
862 > <SR-ATAD5> |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
863 0 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
864 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
865 > <SR-HSE> |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
866 1 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
867 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
868 > <SR-MMP> |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
869 1 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
870 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
871 > <SR-p53> |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
872 1 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
873 |
30c673b5b061
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/PaDEL commit dee96760dea60708d31899d4840191c1e67b5dc7"
bgruening
parents:
diff
changeset
|
874 $$$$ |