Mercurial > repos > bgruening > openbabel_genprop
view test-data/CID_2244_FP4.fps @ 3:480b5b142f2c draft
planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/openbabel commit c376ab981fafb25f0c04a2a313968fa2e55f5196
author | bgruening |
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date | Sat, 20 May 2017 20:05:47 -0400 |
parents | df6d948e95ba |
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