Mercurial > repos > bgruening > openbabel_remions
view test-data/CID_2244_FP2.fps @ 5:ced7c9004627 draft
planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/openbabel commit 81bccfe3545098dc46a377102816e7fae642c95f
author | bgruening |
---|---|
date | Wed, 03 Jan 2018 13:12:17 -0500 |
parents | c9bee3591df9 |
children |
line wrap: on
line source
#FPS1 #num_bits=1021 #type=OpenBabel-FP2/1 #software=OpenBabel/2.3.1 #source=CID_2244.sdf #date=2012-05-15T16:40:38 00000010004000c00000020000030000010000000008000000000080000000000400400000000010200a020800000000000042000000000000800002000002000c200800010001010000000002808002208000400000000040080000000100000008000000000002004002000010000000020100080100200808000000000004 2244