Mercurial > repos > bgruening > openbabel_genprop
view test-data/CID_2244_FP3.fps @ 2:fd93551f84f3 draft
planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/openbabel commit 78ac0521d7df684e96c1b9c1ba2a17b02e681608
author | bgruening |
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date | Sat, 20 May 2017 20:03:20 -0400 |
parents | df6d948e95ba |
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