Mercurial > repos > bgruening > chemfp
annotate chemfp_clustering/old/in.fps @ 29:c0acc635080c
ChemicalToolBoX update.
| author | Bjoern Gruening <bjoern.gruening@gmail.com> |
|---|---|
| date | Tue, 23 Jul 2013 01:02:05 +0200 |
| parents | 438bc12d591b |
| children |
| rev | line source |
|---|---|
| 6 | 1 #FPS1 |
| 2 #num_bits=1021 | |
| 3 #type=OpenBabel-FP2/1 | |
| 4 #software=OpenBabel/2.3.90 | |
| 5 #source=/media/data/web/galaxy-central/database/job_working_directory/065/65986/task_0/dataset_69208.dat | |
| 6 #date=2013-04-12T10:40:57 | |
| 7 00220160a00006e20000e6060f0300e4841084982840200c014e002c0410040014011115004010279800311100043605210244501832c000a2a801162080000144000c302065020881082000c2040738a2088150018a210090800b088049500019b00c08006440811300500021010120104c801102081842100003010a024200 a | |
| 8 00220160a00006e20000e6060f0300e4841084982840200c014e002c0410040014011115004010279800311100043605210244501832c000a2a801162080000144000c302065020881082000c2040738a2088150018a210090800b088049500019b00c08006440811300500021010120104c801102081842100003010a024200 b |
