annotate test-data/list1.txt @ 0:743bd6aa3c7a draft

"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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Ignore whitespace changes - Everywhere: Within whitespace: At end of lines:
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743bd6aa3c7a "planemo upload for repository https://github.com/galaxycomputationalchemistry/galaxy-tools-compchem/ commit 1b23e024af45cc0999d9142d07de6897d4189ec2"
chemteam
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1 resid 212 and name OE2