Mercurial > repos > bgruening > chemfp
comparison test-data/CID_2244_FP2.fps @ 5:57a1a58056a6 draft
planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/chemfp commit d786052cd04f8b25eb4aff80b1b9724f62031b61
author | bgruening |
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date | Sat, 20 May 2017 12:57:06 -0400 |
parents | 70b071de9bee |
children | 0d88631bb7de |
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4:685a138131f0 | 5:57a1a58056a6 |
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1 #FPS1 | |
2 #num_bits=1021 | |
3 #type=OpenBabel-FP2/1 | |
4 #software=OpenBabel/2.4.1 | |
5 #source=/tmp/tmptaAke4/files/000/dataset_3.dat | |
6 #date=2017-05-19T13:52:59 | |
7 00000010004000c00000020000030000010000000008000000000080000000000400400000000010200a020800000000000042000000000000800002000002000c200800010001010000000002808002208000400000000040080000000100000008000000000002004002000010000000020100080100200808000000000004 2244 |