Mercurial > repos > bgruening > autodock_vina_prepare_box
annotate test-data/box_params.txt @ 0:761762031eee draft
planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/autodock_vina commit a657ca32e9a470d710e483e9c3c2706726bec9a3
author | bgruening |
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date | Wed, 17 Apr 2019 09:11:01 -0400 |
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0
761762031eee
planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/autodock_vina commit a657ca32e9a470d710e483e9c3c2706726bec9a3
bgruening
parents:
diff
changeset
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1 |
761762031eee
planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/autodock_vina commit a657ca32e9a470d710e483e9c3c2706726bec9a3
bgruening
parents:
diff
changeset
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2 size_x = 12.443000000000001 |
761762031eee
planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/autodock_vina commit a657ca32e9a470d710e483e9c3c2706726bec9a3
bgruening
parents:
diff
changeset
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3 size_y = 11.888 |
761762031eee
planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/autodock_vina commit a657ca32e9a470d710e483e9c3c2706726bec9a3
bgruening
parents:
diff
changeset
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4 size_z = 9.290999999999997 |
761762031eee
planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/autodock_vina commit a657ca32e9a470d710e483e9c3c2706726bec9a3
bgruening
parents:
diff
changeset
|
5 center_x = -29.8395 |
761762031eee
planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/autodock_vina commit a657ca32e9a470d710e483e9c3c2706726bec9a3
bgruening
parents:
diff
changeset
|
6 center_y = 4.364 |
761762031eee
planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/autodock_vina commit a657ca32e9a470d710e483e9c3c2706726bec9a3
bgruening
parents:
diff
changeset
|
7 center_z = -64.5925 |
761762031eee
planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/autodock_vina commit a657ca32e9a470d710e483e9c3c2706726bec9a3
bgruening
parents:
diff
changeset
|
8 num_modes = 9999 |
761762031eee
planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/autodock_vina commit a657ca32e9a470d710e483e9c3c2706726bec9a3
bgruening
parents:
diff
changeset
|
9 energy_range = 9999 |
761762031eee
planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/autodock_vina commit a657ca32e9a470d710e483e9c3c2706726bec9a3
bgruening
parents:
diff
changeset
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10 exhaustiveness = 10 |
761762031eee
planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/autodock_vina commit a657ca32e9a470d710e483e9c3c2706726bec9a3
bgruening
parents:
diff
changeset
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11 cpu = 4 |
761762031eee
planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/autodock_vina commit a657ca32e9a470d710e483e9c3c2706726bec9a3
bgruening
parents:
diff
changeset
|
12 seed = 1 |
761762031eee
planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/autodock_vina commit a657ca32e9a470d710e483e9c3c2706726bec9a3
bgruening
parents:
diff
changeset
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13 |