Mercurial > repos > bgruening > openbabel_subsearch
view test-data/CID_2244_FP3.fps @ 11:c4abd2c7d5f6 draft
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/openbabel commit cda909c5e0b88fa3d12abe43fc72b8dd0729417a"
author | bgruening |
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date | Thu, 09 Apr 2020 09:59:40 -0400 |
parents | 98e12cc1f3a8 |
children |
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#FPS1 #num_bits=55 #type=OpenBabel-FP3/1 #software=OpenBabel/2.3.1 #source=CID_2244.sdf #date=2012-05-15T16:59:15 0400000c50b007 2244