annotate test-data/outp.tabular @ 14:b9e25ec471eb draft

"planemo upload for repository https://github.com/galaxycomputationalchemistry/galaxy-tools-compchem/tree/master/tools/gromacs commit 5536c9fbb2f680a5f296db81362099e5a68e0587"
author chemteam
date Tue, 22 Mar 2022 17:37:59 +0000
parents bfb65cb551d8
children
Ignore whitespace changes - Everywhere: Within whitespace: At end of lines:
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b9e25ec471eb "planemo upload for repository https://github.com/galaxycomputationalchemistry/galaxy-tools-compchem/tree/master/tools/gromacs commit 5536c9fbb2f680a5f296db81362099e5a68e0587"
chemteam
parents: 6
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1 0.000000 615.943726 310.248291 -565.607910
b9e25ec471eb "planemo upload for repository https://github.com/galaxycomputationalchemistry/galaxy-tools-compchem/tree/master/tools/gromacs commit 5536c9fbb2f680a5f296db81362099e5a68e0587"
chemteam
parents: 6
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2 0.100000 546.932983 285.720825 -652.096558
b9e25ec471eb "planemo upload for repository https://github.com/galaxycomputationalchemistry/galaxy-tools-compchem/tree/master/tools/gromacs commit 5536c9fbb2f680a5f296db81362099e5a68e0587"
chemteam
parents: 6
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3 0.200000 455.540436 312.001129 -764.079712
b9e25ec471eb "planemo upload for repository https://github.com/galaxycomputationalchemistry/galaxy-tools-compchem/tree/master/tools/gromacs commit 5536c9fbb2f680a5f296db81362099e5a68e0587"
chemteam
parents: 6
diff changeset
4 0.300000 399.011078 258.551208 -869.548645
b9e25ec471eb "planemo upload for repository https://github.com/galaxycomputationalchemistry/galaxy-tools-compchem/tree/master/tools/gromacs commit 5536c9fbb2f680a5f296db81362099e5a68e0587"
chemteam
parents: 6
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5 0.400000 375.411926 253.486740 -941.101868
b9e25ec471eb "planemo upload for repository https://github.com/galaxycomputationalchemistry/galaxy-tools-compchem/tree/master/tools/gromacs commit 5536c9fbb2f680a5f296db81362099e5a68e0587"
chemteam
parents: 6
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b9e25ec471eb "planemo upload for repository https://github.com/galaxycomputationalchemistry/galaxy-tools-compchem/tree/master/tools/gromacs commit 5536c9fbb2f680a5f296db81362099e5a68e0587"
chemteam
parents: 6
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7 0.600000 311.339386 262.261047 -1042.604736
b9e25ec471eb "planemo upload for repository https://github.com/galaxycomputationalchemistry/galaxy-tools-compchem/tree/master/tools/gromacs commit 5536c9fbb2f680a5f296db81362099e5a68e0587"
chemteam
parents: 6
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b9e25ec471eb "planemo upload for repository https://github.com/galaxycomputationalchemistry/galaxy-tools-compchem/tree/master/tools/gromacs commit 5536c9fbb2f680a5f296db81362099e5a68e0587"
chemteam
parents: 6
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9 0.800000 281.326874 223.785217 -1115.218750
b9e25ec471eb "planemo upload for repository https://github.com/galaxycomputationalchemistry/galaxy-tools-compchem/tree/master/tools/gromacs commit 5536c9fbb2f680a5f296db81362099e5a68e0587"
chemteam
parents: 6
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10 0.900000 272.021881 237.265472 -1073.441406
b9e25ec471eb "planemo upload for repository https://github.com/galaxycomputationalchemistry/galaxy-tools-compchem/tree/master/tools/gromacs commit 5536c9fbb2f680a5f296db81362099e5a68e0587"
chemteam
parents: 6
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11 1.000000 304.201172 216.940704 -1089.731323