source: tests/regression/Fragmentation/AnalyseFragmentationResults/pre@ cdac1d

SaturateAtoms_singleDegree
Name Size Rev Age Author Last Change
../
alkane-3.pdb 3.2 KB 6ff62c   12 years FrederikHeber Added DoValenceOnly has new option to FragmentationAutomationAction. …
BondFragmentLongRangeResults_OBC.dat 4.8 MB d93d2c   9 years FrederikHeber FIX: Long-range forces were not added onto atom's forces. - this was …
BondFragmentLongRangeResults_PBC.dat 4.7 MB d93d2c   9 years FrederikHeber FIX: Long-range forces were not added onto atom's forces. - this was …
BondFragmentShortRangeResults.dat 51.5 KB d93d2c   9 years FrederikHeber FIX: Long-range forces were not added onto atom's forces. - this was …
  • Property mode set to 040000
Note: See TracBrowser for help on using the repository browser.