source: tests/regression/Fragmentation/FragmentMolecule/post@ 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
../
test.conf 4.1 KB ​ 7811bf   14 years FrederikHeber Changed regression testsuite structure of Fragmentation. - all …
BondFragmentTE-Factors.dat 10 bytes ​ 7811bf   14 years FrederikHeber Changed regression testsuite structure of Fragmentation. - all …
BondFragmentOrderAtSite.dat 67 bytes ​ 7811bf   14 years FrederikHeber Changed regression testsuite structure of Fragmentation. - all …
BondFragmentKeySets.dat 14 bytes ​ 7811bf   14 years FrederikHeber Changed regression testsuite structure of Fragmentation. - all …
BondFragmentForces-Factors.dat 75 bytes ​ 7811bf   14 years FrederikHeber Changed regression testsuite structure of Fragmentation. - all …
BondFragmentAdjacency.dat 75 bytes ​ 7811bf   14 years FrederikHeber Changed regression testsuite structure of Fragmentation. - all …
BondFragment4.xyz 270 bytes ​ 7811bf   14 years FrederikHeber Changed regression testsuite structure of Fragmentation. - all …
BondFragment4.conf 4.0 KB ​ 7811bf   14 years FrederikHeber Changed regression testsuite structure of Fragmentation. - all …
BondFragment3.xyz 269 bytes ​ 7811bf   14 years FrederikHeber Changed regression testsuite structure of Fragmentation. - all …
BondFragment3.conf 4.0 KB ​ 7811bf   14 years FrederikHeber Changed regression testsuite structure of Fragmentation. - all …
BondFragment2.xyz 189 bytes ​ 7811bf   14 years FrederikHeber Changed regression testsuite structure of Fragmentation. - all …
BondFragment2.conf 3.8 KB ​ 7811bf   14 years FrederikHeber Changed regression testsuite structure of Fragmentation. - all …
BondFragment1.xyz 189 bytes ​ 7811bf   14 years FrederikHeber Changed regression testsuite structure of Fragmentation. - all …
BondFragment1.conf 3.8 KB ​ 7811bf   14 years FrederikHeber Changed regression testsuite structure of Fragmentation. - all …
BondFragment0.xyz 187 bytes ​ 7811bf   14 years FrederikHeber Changed regression testsuite structure of Fragmentation. - all …
BondFragment0.conf 3.8 KB ​ 7811bf   14 years FrederikHeber Changed regression testsuite structure of Fragmentation. - all …
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