ForceAnnealing_goodresults
ForceAnnealing_tocheck
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Last change
on this file since b94e74 was 7811bf, checked in by Frederik Heber <heber@…>, 15 years ago |
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Changed regression testsuite structure of Fragmentation.
- all numbered test cases now have meaningful names.
- renamed token of FragmentMoleculeAction: fragment-mol -> fragment-molecule.
- removed test case 1 where test.conf is checked, this is made sure elswhere.
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-
Property mode
set to
100644
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File size:
269 bytes
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| Rev | Line | |
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| [ebcade] | 1 | 8
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| 2 | Created by molecuilder on Tue Oct 6 19:01:29 2009
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| 3 | C 9.78209 3.27519 3.53589
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| 4 | C 8.53279 4.15859 3.53589
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| 5 | H 9.78209 2.64589 2.64589
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| 6 | H 9.78209 2.64589 4.42589
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| 7 | H 10.672 3.90454 3.53589
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| 8 | H 7.64283 3.52924 3.53589
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| 9 | H 8.53279 4.78789 2.64589
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| 10 | H 8.53279 4.78789 4.42589
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