source: tests/regression/Fragmentation/AnalyseFragmentationResults/post@ eaf08f

Fix_FitPartialCharges
Name Size Rev Age Author Last Change
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LongRange d93d2c   10 years FrederikHeber FIX: Long-range forces were not added onto atom's forces. - this was …
ShortRange d93d2c   10 years FrederikHeber FIX: Long-range forces were not added onto atom's forces. - this was …
alkane-3.data 1.3 KB e5ebaf   12 years FrederikHeber Forces obtained from fragmentation summation are now set. - i.e. they …
  • Property mode set to 040000
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