Mercurial > repos > chemteam > mdanalysis_extract_rmsd

comparison test-data/Dihedral_analysis_raw_data.tabular @ 0:743bd6aa3c7a draft

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"planemo upload for repository https://github.com/galaxycomputationalchemistry/galaxy-tools-compchem/ commit 1b23e024af45cc0999d9142d07de6897d4189ec2"
author chemteam
date Mon, 24 Aug 2020 16:41:41 -0400
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-1:000000000000 0:743bd6aa3c7a
1 0 -61.75347431106646
2 1 -63.57940223575045
3 2 -64.3468375822089
4 3 -64.2932006449013
5 4 -66.17815780069928
6 5 -64.57418410935712
7 6 -63.95470182210953
8 7 -63.215898370961455
9 8 -63.05227933072821
10 9 -63.350881174296354
11 10 -64.12889787645014
12 11 -59.11099982465991
13 12 -76.10678081593274
14 13 -74.55530125465415
15 14 -71.01850912317343