source: tests/regression/Fragmentation/AnalyseFragmentationResults/post/LongRange/OBC@ 866dec

AutomationFragmentation_failures Candidate_v1.6.1 ChemicalSpaceEvaluator Enhanced_StructuralOptimization_continued Exclude_Hydrogens_annealWithBondGraph ForceAnnealing_with_BondGraph ForceAnnealing_with_BondGraph_contraction-expansion Gui_displays_atomic_force_velocity PythonUI_with_named_parameters StoppableMakroAction TremoloParser_IncreasedPrecision
Name Size Rev Age Author Last Change
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alkane-3.data 1.3 KB ​ 866dec   7 years frederik.heber ForceAnnealing no longer resets forces, AnalyseFragmentResults now …
BondFragment_Eigenhistogram.dat 4.1 KB ​ d93d2c   9 years FrederikHeber FIX: Long-range forces were not added onto atom's forces. - this was …
BondFragment_Eigenvalues.dat 14.2 KB ​ d93d2c   9 years FrederikHeber FIX: Long-range forces were not added onto atom's forces. - this was …
BondFragment_Energy.dat 642 bytes ​ d93d2c   9 years FrederikHeber FIX: Long-range forces were not added onto atom's forces. - this was …
BondFragment_Forces.dat 6.9 KB ​ d93d2c   9 years FrederikHeber FIX: Long-range forces were not added onto atom's forces. - this was …
BondFragment_IndexedEnergy.dat 4.2 KB ​ d93d2c   9 years FrederikHeber FIX: Long-range forces were not added onto atom's forces. - this was …
BondFragment_LongRangeEnergy.dat 771 bytes ​ d93d2c   9 years FrederikHeber FIX: Long-range forces were not added onto atom's forces. - this was …
BondFragment_LongRangeForces.dat 12.9 KB ​ d93d2c   9 years FrederikHeber FIX: Long-range forces were not added onto atom's forces. - this was …
BondFragment_Times.dat 363 bytes ​ d03800   8 years FrederikHeber TESTFIX: Redid all fragmentation containers for associated …
BondFragment_VMGEnergy.dat 196 bytes ​ d93d2c   9 years FrederikHeber FIX: Long-range forces were not added onto atom's forces. - this was …
BondFragment_VMGForces.dat 6.2 KB ​ d93d2c   9 years FrederikHeber FIX: Long-range forces were not added onto atom's forces. - this was …
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