Mercurial > repos > bgruening > chemfp
view test-data/CID_2244_FP3.fps @ 7:0d88631bb7de draft
planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/chemfp commit ed9b6859de648aa5f7cde483732f5df20aaff90e
author | bgruening |
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date | Tue, 07 May 2019 13:32:50 -0400 |
parents | 70b071de9bee |
children | 92c7cdc243e8 |
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#FPS1 #num_bits=55 #type=OpenBabel-FP3/1 #software=OpenBabel/2.4.1 chemfp/1.5 #source=CID_2244.sdf #date=2019-05-03T12:39:21 0400000c50b007 2244