source: tests/regression/Atoms/Add/post@ 3f6aac

Action_Thermostats Add_SelectAtomByNameAction Adding_Graph_to_ChangeBondActions Adding_MD_integration_tests Adding_StructOpt_integration_tests AutomationFragmentation_failures Candidate_v1.6.1 ChemicalSpaceEvaluator EmpiricalPotential_contain_HomologyGraph_documentation Enhanced_StructuralOptimization Enhanced_StructuralOptimization_continued Example_ManyWaysToTranslateAtom Exclude_Hydrogens_annealWithBondGraph Fix_Verbose_Codepatterns ForceAnnealing_oldresults ForceAnnealing_with_BondGraph ForceAnnealing_with_BondGraph_continued ForceAnnealing_with_BondGraph_continued_betteresults ForceAnnealing_with_BondGraph_contraction-expansion Gui_displays_atomic_force_velocity IndependentFragmentGrids_IntegrationTest JobMarket_RobustOnKillsSegFaults JobMarket_StableWorkerPool PythonUI_with_named_parameters Recreated_GuiChecks StoppableMakroAction TremoloParser_IncreasedPrecision TremoloParser_MultipleTimesteps
Name Size Rev Age Author Last Change
../
test.xyz 65 bytes ​ d445e4   14 years FrederikHeber Changed regression testsuite structure of Atoms. - All atom-related …
test.pdb 143 bytes ​ ceaab1   9 years FrederikHeber AddAtom now adds a molecule (atom always associated with a molecule). …
test.in 443 bytes ​ 3fb9ab   9 years FrederikHeber FIX: Preventing MPQC from using old temp files for restart. - …
test.data 221 bytes ​ e6e4a0   12 years FrederikHeber FIX: TremoloParser did not treat key F properly in saveLine() and …
test.conf 3.5 KB ​ d445e4   14 years FrederikHeber Changed regression testsuite structure of Atoms. - All atom-related …
empty.conf 3.3 KB ​ f73351   12 years FrederikHeber FIX: Some Thermostats would cause NaN on zero temperature. - …
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