Mercurial > repos > bgruening > chemfp

view test-data/CID_2244_MACCS.fps @ 2:70b071de9bee draft

Find changesets by keywords (author, files, the commit message), revision number or hash, or revset expression.
planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/chemfp commit 01da22e4184a5a6f6a3dd4631a7b9c31d1b6d502
author bgruening
date Sat, 20 May 2017 08:31:44 -0400
parents
children 0d88631bb7de
line wrap: on
line source

#FPS1
#num_bits=1021
#type=OpenBabel-FP2/1
#software=OpenBabel/2.4.1
#source=/tmp/tmptaAke4/files/000/dataset_15.dat
#date=2017-05-19T13:55:30
00000010004000c00000020000030000010000000008000000000080000000000400400000000010200a020800000000000042000000000000800002000002000c200800010001010000000002808002208000400000000040080000000100000008000000000002004002000010000000020100080100200808000000000004	2244