source: src/Actions/AnalysisAction@ 2ced6b

Action_Thermostats Add_AtomRandomPerturbation Add_FitFragmentPartialChargesAction Add_RotateAroundBondAction Add_SelectAtomByNameAction Added_ParseSaveFragmentResults AddingActions_SaveParseParticleParameters Adding_Graph_to_ChangeBondActions Adding_MD_integration_tests Adding_ParticleName_to_Atom Adding_StructOpt_integration_tests AtomFragments Automaking_mpqc_open AutomationFragmentation_failures Candidate_v1.5.4 Candidate_v1.6.0 Candidate_v1.6.1 Candidate_v1.7.0 ChangeBugEmailaddress ChangingTestPorts ChemicalSpaceEvaluator CombiningParticlePotentialParsing Combining_Subpackages Debian_Package_split Debian_package_split_molecuildergui_only Disabling_MemDebug Docu_Python_wait EmpiricalPotential_contain_HomologyGraph EmpiricalPotential_contain_HomologyGraph_documentation Enable_parallel_make_install Enhance_userguide Enhanced_StructuralOptimization Enhanced_StructuralOptimization_continued Example_ManyWaysToTranslateAtom Exclude_Hydrogens_annealWithBondGraph FitPartialCharges_GlobalError Fix_BoundInBox_CenterInBox_MoleculeActions Fix_ChargeSampling_PBC Fix_ChronosMutex Fix_FitPartialCharges Fix_FitPotential_needs_atomicnumbers Fix_ForceAnnealing Fix_IndependentFragmentGrids Fix_ParseParticles Fix_ParseParticles_split_forward_backward_Actions Fix_PopActions Fix_QtFragmentList_sorted_selection Fix_Restrictedkeyset_FragmentMolecule Fix_StatusMsg Fix_StepWorldTime_single_argument Fix_Verbose_Codepatterns Fix_fitting_potentials Fixes ForceAnnealing_goodresults ForceAnnealing_oldresults ForceAnnealing_tocheck ForceAnnealing_with_BondGraph ForceAnnealing_with_BondGraph_continued ForceAnnealing_with_BondGraph_continued_betteresults ForceAnnealing_with_BondGraph_contraction-expansion FragmentAction_writes_AtomFragments FragmentMolecule_checks_bonddegrees GeometryObjects Gui_Fixes Gui_displays_atomic_force_velocity ImplicitCharges IndependentFragmentGrids IndependentFragmentGrids_IndividualZeroInstances IndependentFragmentGrids_IntegrationTest IndependentFragmentGrids_Sole_NN_Calculation JobMarket_RobustOnKillsSegFaults JobMarket_StableWorkerPool JobMarket_unresolvable_hostname_fix MoreRobust_FragmentAutomation ODR_violation_mpqc_open PartialCharges_OrthogonalSummation PdbParser_setsAtomName PythonUI_with_named_parameters QtGui_reactivate_TimeChanged_changes Recreated_GuiChecks Rewrite_FitPartialCharges RotateToPrincipalAxisSystem_UndoRedo SaturateAtoms_findBestMatching SaturateAtoms_singleDegree StoppableMakroAction Subpackage_CodePatterns Subpackage_JobMarket Subpackage_LinearAlgebra Subpackage_levmar Subpackage_mpqc_open Subpackage_vmg Switchable_LogView ThirdParty_MPQC_rebuilt_buildsystem TrajectoryDependenant_MaxOrder TremoloParser_IncreasedPrecision TremoloParser_MultipleTimesteps TremoloParser_setsAtomName Ubuntu_1604_changes stable
Name Size Rev Age Author Last Change
../
CalculateBoundingBoxAction.cpp 1.7 KB ​ d103d3   14 years FrederikHeber Added additional check in CodeCheck's project disclaimer for current …
CalculateBoundingBoxAction.def 1.0 KB ​ f89b45   14 years FrederikHeber Added Reaction CalculateBoundingBoxAction. - calculate bounding box …
CalculateBoundingBoxAction.hpp 404 bytes ​ f89b45   14 years FrederikHeber Added Reaction CalculateBoundingBoxAction. - calculate bounding box …
CalculateCellVolumeAction.cpp 1.2 KB ​ d103d3   14 years FrederikHeber Added additional check in CodeCheck's project disclaimer for current …
CalculateCellVolumeAction.def 960 bytes ​ 54088a   14 years FrederikHeber Added first Reaction named CalculateCellVolumeAction. - this sets the …
CalculateCellVolumeAction.hpp 399 bytes ​ 54088a   14 years FrederikHeber Added first Reaction named CalculateCellVolumeAction. - this sets the …
CalculateMolarMassAction.cpp 1.4 KB ​ 6f0841   14 years FrederikHeber Shifted all modules related to atoms into own subfolder src/Atom/ - …
CalculateMolarMassAction.def 958 bytes ​ 55f299   14 years FrederikHeber Added Reaction CalculateMolarMassAction. - calculate molar mass …
CalculateMolarMassAction.hpp 394 bytes ​ 55f299   14 years FrederikHeber Added Reaction CalculateMolarMassAction. - calculate molar mass …
DipoleAngularCorrelationAction.cpp 5.0 KB ​ aa6c75   14 years FrederikHeber Removed some unnecessary LinkedCell.hpp include's.
DipoleAngularCorrelationAction.def 1.6 KB ​ c3a70d   14 years FrederikHeber Added time-step-zero option to dipole-angular-correlation. - this …
DipoleAngularCorrelationAction.hpp 419 bytes ​ 208237b   14 years FrederikHeber Renamed DipoleAngularCorrelation(Action) -> DipoleCorrelation(Action) …
DipoleCorrelationAction.cpp 2.5 KB ​ aa6c75   14 years FrederikHeber Removed some unnecessary LinkedCell.hpp include's.
DipoleCorrelationAction.def 1.4 KB ​ 208237b   14 years FrederikHeber Renamed DipoleAngularCorrelation(Action) -> DipoleCorrelation(Action) …
DipoleCorrelationAction.hpp 383 bytes ​ 208237b   14 years FrederikHeber Renamed DipoleAngularCorrelation(Action) -> DipoleCorrelation(Action) …
MolecularVolumeAction.cpp 2.8 KB ​ 6bd7e0   14 years FrederikHeber Renamed old LinkedCell class to LinkedCell_deprecated. - this is …
MolecularVolumeAction.def 873 bytes ​ e4afb4   15 years FrederikHeber Huge refactoring: Introduction of Traits to Actions. This change is …
MolecularVolumeAction.hpp 382 bytes ​ 9ee38b   15 years FrederikHeber Extended macro framework. Extensions: - all central definitions …
PairCorrelationAction.cpp 2.5 KB ​ aa6c75   14 years FrederikHeber Removed some unnecessary LinkedCell.hpp include's.
PairCorrelationAction.def 1.5 KB ​ e4afb4   15 years FrederikHeber Huge refactoring: Introduction of Traits to Actions. This change is …
PairCorrelationAction.hpp 373 bytes ​ 9ee38b   15 years FrederikHeber Extended macro framework. Extensions: - all central definitions …
PointCorrelationAction.cpp 2.8 KB ​ aa6c75   14 years FrederikHeber Removed some unnecessary LinkedCell.hpp include's.
PointCorrelationAction.def 1.6 KB ​ e4afb4   15 years FrederikHeber Huge refactoring: Introduction of Traits to Actions. This change is …
PointCorrelationAction.hpp 378 bytes ​ 9ee38b   15 years FrederikHeber Extended macro framework. Extensions: - all central definitions …
PrincipalAxisSystemAction.cpp 2.1 KB ​ d103d3   14 years FrederikHeber Added additional check in CodeCheck's project disclaimer for current …
PrincipalAxisSystemAction.def 953 bytes ​ e4afb4   15 years FrederikHeber Huge refactoring: Introduction of Traits to Actions. This change is …
PrincipalAxisSystemAction.hpp 395 bytes ​ 56f73b   15 years FrederikHeber Added config.h also to all header files, code check test ascertain …
SurfaceCorrelationAction.cpp 3.8 KB ​ 6bd7e0   14 years FrederikHeber Renamed old LinkedCell class to LinkedCell_deprecated. - this is …
SurfaceCorrelationAction.def 1.6 KB ​ e4afb4   15 years FrederikHeber Huge refactoring: Introduction of Traits to Actions. This change is …
SurfaceCorrelationAction.hpp 389 bytes ​ 56f73b   15 years FrederikHeber Added config.h also to all header files, code check test ascertain …
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