comparison test-data/CID_2244_maccs.fps @ 0:933eb20bef51 draft

"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/openbabel commit 6c84abdd07f292048bf2194073e2e938e94158c4"
author bgruening
date Wed, 25 Mar 2020 20:37:36 +0000
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-1:000000000000 0:933eb20bef51
1 #FPS1
2 #num_bits=166
3 #type=OpenBabel-MACCS/2
4 #software=OpenBabel/2.3.1
5 #source=CID_2244.sdf
6 #date=2012-05-15T17:00:39
7 0000000000000000000000010000016480cca2d21e 2244