source: src/Actions/AtomAction@ 5e17bf

Action_Thermostats Add_AtomRandomPerturbation Add_RotateAroundBondAction Add_SelectAtomByNameAction Adding_Graph_to_ChangeBondActions Adding_MD_integration_tests Adding_StructOpt_integration_tests AutomationFragmentation_failures Candidate_v1.6.1 ChangeBugEmailaddress ChemicalSpaceEvaluator Docu_Python_wait EmpiricalPotential_contain_HomologyGraph_documentation Enhance_userguide Enhanced_StructuralOptimization Enhanced_StructuralOptimization_continued Example_ManyWaysToTranslateAtom Exclude_Hydrogens_annealWithBondGraph Fix_StatusMsg Fix_StepWorldTime_single_argument 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 QtGui_reactivate_TimeChanged_changes Recreated_GuiChecks RotateToPrincipalAxisSystem_UndoRedo StoppableMakroAction TremoloParser_IncreasedPrecision TremoloParser_MultipleTimesteps
Name Size Rev Age Author Last Change
../
AddAction.cpp 5.4 KB ​ 9eb71b3   8 years frederik.heber Commented out MemDebug include and Memory::ignore. - MemDebug clashes …
AddAction.def 1.4 KB ​ ceaab1   9 years FrederikHeber AddAtom now adds a molecule (atom always associated with a molecule). …
AddAction.hpp 326 bytes ​ cb2465   12 years FrederikHeber FIX: Changed Atom's AddAction and RemoveAction header inclusion …
ChangeElementAction.cpp 3.4 KB ​ 9eb71b3   8 years frederik.heber Commented out MemDebug include and Memory::ignore. - MemDebug clashes …
ChangeElementAction.def 1.2 KB ​ 6ba9ba   13 years FrederikHeber Default values are properly set by the Action into their …
ChangeElementAction.hpp 362 bytes ​ 56f73b   14 years FrederikHeber Added config.h also to all header files, code check test ascertain …
MirrorAction.cpp 3.9 KB ​ 9eb71b3   8 years frederik.heber Commented out MemDebug include and Memory::ignore. - MemDebug clashes …
MirrorAction.def 1.5 KB ​ bbf6dc   10 years FrederikHeber Added AtomMirrorAction. - also added regression tests.
MirrorAction.hpp 324 bytes ​ bbf6dc   10 years FrederikHeber Added AtomMirrorAction. - also added regression tests.
RemoveAction.cpp 3.1 KB ​ 9eb71b3   8 years frederik.heber Commented out MemDebug include and Memory::ignore. - MemDebug clashes …
RemoveAction.def 936 bytes ​ 1a48d2   10 years FrederikHeber Added ForceAnnealingAction. - also added regression test. - performs …
RemoveAction.hpp 341 bytes ​ cb2465   12 years FrederikHeber FIX: Changed Atom's AddAction and RemoveAction header inclusion …
RotateAroundOriginByAngleAction.cpp 3.9 KB ​ 9eb71b3   8 years frederik.heber Commented out MemDebug include and Memory::ignore. - MemDebug clashes …
RotateAroundOriginByAngleAction.def 1.3 KB ​ 7a1e7d   12 years ankele VectorNotZeroValidator added (for actions using rotation axis)
RotateAroundOriginByAngleAction.hpp 419 bytes ​ 56f73b   14 years FrederikHeber Added config.h also to all header files, code check test ascertain …
SaturateAction.cpp 5.8 KB ​ 9eb71b3   8 years frederik.heber Commented out MemDebug include and Memory::ignore. - MemDebug clashes …
SaturateAction.def 1.0 KB ​ 2fcef3   10 years FrederikHeber Added SaturateAction that uses SphericalPointDistribution. - added …
SaturateAction.hpp 334 bytes ​ 2fcef3   10 years FrederikHeber Added SaturateAction that uses SphericalPointDistribution. - added …
SaveSelectedAtomsAction.cpp 3.2 KB ​ 9eb71b3   8 years frederik.heber Commented out MemDebug include and Memory::ignore. - MemDebug clashes …
SaveSelectedAtomsAction.def 1.2 KB ​ 6ba9ba   13 years FrederikHeber Default values are properly set by the Action into their …
SaveSelectedAtomsAction.hpp 384 bytes ​ fe6f20   14 years FrederikHeber New Action SaveSelectedAtoms and renamed SaveAction -> …
TranslateAction.cpp 3.2 KB ​ 9eb71b3   8 years frederik.heber Commented out MemDebug include and Memory::ignore. - MemDebug clashes …
TranslateAction.def 1.3 KB ​ 066442   10 years FrederikHeber Added TranslateMolecule action. - added translate-molecule to …
TranslateAction.hpp 339 bytes ​ 56f73b   14 years FrederikHeber Added config.h also to all header files, code check test ascertain …
TranslateToOriginAction.cpp 3.3 KB ​ 9eb71b3   8 years frederik.heber Commented out MemDebug include and Memory::ignore. - MemDebug clashes …
TranslateToOriginAction.def 1.0 KB ​ c7fe90   10 years FrederikHeber Added TranslateToOriginAction. - also added regression test.
TranslateToOriginAction.hpp 379 bytes ​ c7fe90   10 years FrederikHeber Added TranslateToOriginAction. - also added regression test.
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