Mercurial > repos > bgruening > prepare_ligands_for_docking
view test-data/CID_2244_FP2.fps @ 7:fac2c28b4c55 draft default tip
planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/openbabel commit d9c51279c061a1da948a2582d5b502ca7573adbf
author | bgruening |
---|---|
date | Thu, 15 Aug 2024 11:04:16 +0000 |
parents | 06340f46ecb8 |
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