Mercurial > repos > bgruening > chemfp

view test-data/CID_2244_FP3.fps @ 10:73de2fe4bf92 draft

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"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/chemfp commit deb7ad38cefd13df312431b1138054a68381efdf"
author bgruening
date Fri, 18 Oct 2019 04:57:52 -0400
parents 0d88631bb7de
children 92c7cdc243e8
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#FPS1
#num_bits=55
#type=OpenBabel-FP3/1
#software=OpenBabel/2.4.1 chemfp/1.5
#source=CID_2244.sdf
#date=2019-05-03T12:39:21
0400000c50b007	2244