Mercurial > repos > chemteam > parmconv
annotate test-data/cid1.inpcrd @ 9:6d0677a148fe draft default tip
"planemo upload for repository https://github.com/galaxycomputationalchemistry/galaxy-tools-compchem/ commit def3e8d4a983ab47ceedde678f585b54c79bb8d1"
| author | chemteam |
|---|---|
| date | Thu, 27 Jan 2022 17:17:20 +0000 |
| parents | 30120022aa5c |
| children |
| rev | line source |
|---|---|
|
8
30120022aa5c
"planemo upload for repository https://github.com/galaxycomputationalchemistry/galaxy-tools-compchem/ commit f6acbf6f5875904c5b0c69445da0bf44932611c6"
chemteam
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1 default_name |
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30120022aa5c
"planemo upload for repository https://github.com/galaxycomputationalchemistry/galaxy-tools-compchem/ commit f6acbf6f5875904c5b0c69445da0bf44932611c6"
chemteam
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2 42 |
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30120022aa5c
"planemo upload for repository https://github.com/galaxycomputationalchemistry/galaxy-tools-compchem/ commit f6acbf6f5875904c5b0c69445da0bf44932611c6"
chemteam
parents:
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3 413.7160000 -23.8940000 73.9880000 413.0110000 -23.1360000 73.0600000 |
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30120022aa5c
"planemo upload for repository https://github.com/galaxycomputationalchemistry/galaxy-tools-compchem/ commit f6acbf6f5875904c5b0c69445da0bf44932611c6"
chemteam
parents:
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4 410.4130000 -22.8270000 77.7640000 413.0830000 -24.9950000 74.5420000 |
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30120022aa5c
"planemo upload for repository https://github.com/galaxycomputationalchemistry/galaxy-tools-compchem/ commit f6acbf6f5875904c5b0c69445da0bf44932611c6"
chemteam
parents:
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5 411.1680000 -24.6150000 73.3300000 412.1350000 -21.4560000 78.2360000 |
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30120022aa5c
"planemo upload for repository https://github.com/galaxycomputationalchemistry/galaxy-tools-compchem/ commit f6acbf6f5875904c5b0c69445da0bf44932611c6"
chemteam
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6 411.7120000 -23.4970000 72.7190000 411.3590000 -22.4680000 78.7560000 |
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30120022aa5c
"planemo upload for repository https://github.com/galaxycomputationalchemistry/galaxy-tools-compchem/ commit f6acbf6f5875904c5b0c69445da0bf44932611c6"
chemteam
parents:
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7 410.6390000 -22.0230000 76.6690000 409.9160000 -22.0060000 75.3710000 |
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30120022aa5c
"planemo upload for repository https://github.com/galaxycomputationalchemistry/galaxy-tools-compchem/ commit f6acbf6f5875904c5b0c69445da0bf44932611c6"
chemteam
parents:
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8 410.3560000 -20.6120000 70.7060000 411.2760000 -21.2970000 69.7140000 |
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30120022aa5c
"planemo upload for repository https://github.com/galaxycomputationalchemistry/galaxy-tools-compchem/ commit f6acbf6f5875904c5b0c69445da0bf44932611c6"
chemteam
parents:
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9 410.9200000 -22.6950000 71.7140000 410.7700000 -21.2020000 72.0480000 |
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30120022aa5c
"planemo upload for repository https://github.com/galaxycomputationalchemistry/galaxy-tools-compchem/ commit f6acbf6f5875904c5b0c69445da0bf44932611c6"
chemteam
parents:
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10 411.0860000 -23.8010000 69.4340000 409.7500000 -20.9270000 73.1430000 |
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30120022aa5c
"planemo upload for repository https://github.com/galaxycomputationalchemistry/galaxy-tools-compchem/ commit f6acbf6f5875904c5b0c69445da0bf44932611c6"
chemteam
parents:
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11 411.8220000 -25.3760000 74.2360000 411.6890000 -21.1940000 76.9670000 |
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30120022aa5c
"planemo upload for repository https://github.com/galaxycomputationalchemistry/galaxy-tools-compchem/ commit f6acbf6f5875904c5b0c69445da0bf44932611c6"
chemteam
parents:
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12 410.3570000 -21.0800000 74.4240000 411.5380000 -22.6710000 70.3070000 |
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30120022aa5c
"planemo upload for repository https://github.com/galaxycomputationalchemistry/galaxy-tools-compchem/ commit f6acbf6f5875904c5b0c69445da0bf44932611c6"
chemteam
parents:
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13 408.9730000 -22.7740000 75.2000000 411.4870000 -23.1760000 80.2920000 |
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30120022aa5c
"planemo upload for repository https://github.com/galaxycomputationalchemistry/galaxy-tools-compchem/ commit f6acbf6f5875904c5b0c69445da0bf44932611c6"
chemteam
parents:
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14 414.7300000 -23.6320000 74.2690000 413.4810000 -22.2670000 72.6080000 |
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30120022aa5c
"planemo upload for repository https://github.com/galaxycomputationalchemistry/galaxy-tools-compchem/ commit f6acbf6f5875904c5b0c69445da0bf44932611c6"
chemteam
parents:
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15 409.6480000 -23.5890000 77.8390000 413.5900000 -25.6180000 75.2710000 |
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30120022aa5c
"planemo upload for repository https://github.com/galaxycomputationalchemistry/galaxy-tools-compchem/ commit f6acbf6f5875904c5b0c69445da0bf44932611c6"
chemteam
parents:
diff
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16 410.1590000 -24.9450000 73.1040000 412.9630000 -20.8980000 78.6520000 |
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30120022aa5c
"planemo upload for repository https://github.com/galaxycomputationalchemistry/galaxy-tools-compchem/ commit f6acbf6f5875904c5b0c69445da0bf44932611c6"
chemteam
parents:
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17 410.4620000 -19.5230000 70.6760000 409.3110000 -20.8540000 70.4760000 |
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30120022aa5c
"planemo upload for repository https://github.com/galaxycomputationalchemistry/galaxy-tools-compchem/ commit f6acbf6f5875904c5b0c69445da0bf44932611c6"
chemteam
parents:
diff
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18 410.8360000 -21.3960000 68.7180000 412.2480000 -20.7980000 69.6480000 |
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30120022aa5c
"planemo upload for repository https://github.com/galaxycomputationalchemistry/galaxy-tools-compchem/ commit f6acbf6f5875904c5b0c69445da0bf44932611c6"
chemteam
parents:
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19 409.9150000 -23.1650000 71.6000000 411.7370000 -20.7780000 72.3500000 |
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30120022aa5c
"planemo upload for repository https://github.com/galaxycomputationalchemistry/galaxy-tools-compchem/ commit f6acbf6f5875904c5b0c69445da0bf44932611c6"
chemteam
parents:
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20 410.0030000 -23.7210000 69.3180000 411.5930000 -23.7040000 68.4720000 |
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30120022aa5c
"planemo upload for repository https://github.com/galaxycomputationalchemistry/galaxy-tools-compchem/ commit f6acbf6f5875904c5b0c69445da0bf44932611c6"
chemteam
parents:
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21 411.3590000 -24.7350000 69.9290000 408.9340000 -21.6350000 73.0500000 |
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30120022aa5c
"planemo upload for repository https://github.com/galaxycomputationalchemistry/galaxy-tools-compchem/ commit f6acbf6f5875904c5b0c69445da0bf44932611c6"
chemteam
parents:
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22 409.3820000 -19.9130000 73.0430000 412.0760000 -20.4940000 76.3480000 |
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30120022aa5c
"planemo upload for repository https://github.com/galaxycomputationalchemistry/galaxy-tools-compchem/ commit f6acbf6f5875904c5b0c69445da0bf44932611c6"
chemteam
parents:
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23 411.1120000 -20.4360000 74.6780000 412.5590000 -22.7580000 70.4090000 |