Mercurial > repos > bgruening > openbabel_addh
view test-data/CID_2244_FP4.fps @ 11:716dcb5bbb71 draft
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/openbabel commit cda909c5e0b88fa3d12abe43fc72b8dd0729417a"
author | bgruening |
---|---|
date | Thu, 09 Apr 2020 10:06:25 -0400 |
parents | ada6daa717d2 |
children |
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#FPS1 #num_bits=307 #type=OpenBabel-FP4/1 #software=OpenBabel/2.3.1 #source=CID_2244.sdf #date=2012-05-15T16:59:22 010000000000000000009800000000004001000000000000000000000000000000000240402801 2244