source: src/Actions/GraphAction@ fae462

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 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
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CorrectBondDegreeAction.cpp 5.2 KB ​ dc798d   10 years FrederikHeber FIX: Removed some misleading output of CorrectBondDegreeAction.
CorrectBondDegreeAction.def 1.0 KB ​ 343c5a   10 years FrederikHeber Added CorrectBondDegreeAction and fixed Calculation tests. - pdb …
CorrectBondDegreeAction.hpp 385 bytes ​ 343c5a   10 years FrederikHeber Added CorrectBondDegreeAction and fixed Calculation tests. - pdb …
CreateAdjacencyAction.cpp 5.5 KB ​ b5b01e   11 years FrederikHeber ActionState extracted into own header file, rename Action::state_ptr …
CreateAdjacencyAction.def 1.0 KB ​ 055ad7   12 years FrederikHeber Added Undo/Redo functionality to CreateAdjacencyAction. - also added …
CreateAdjacencyAction.hpp 374 bytes ​ d09093   14 years FrederikHeber Moved all graph-related Actions into own folder Actions/GraphAction/. …
DepthFirstSearchAction.cpp 3.1 KB ​ b5b01e   11 years FrederikHeber ActionState extracted into own header file, rename Action::state_ptr …
DepthFirstSearchAction.def 1.1 KB ​ 9291d04   12 years FrederikHeber Split saturation with hydrogen of treatment of hydrogen. - now …
DepthFirstSearchAction.hpp 379 bytes ​ d09093   14 years FrederikHeber Moved all graph-related Actions into own folder Actions/GraphAction/. …
DestroyAdjacencyAction.cpp 5.1 KB ​ 26b4d62   11 years FrederikHeber All Actions now give correct failure status via STATUS() macro.
DestroyAdjacencyAction.def 1.0 KB ​ 560cbf   12 years FrederikHeber Added a DestroyAdjacencyAction with undo/redo. - also added …
DestroyAdjacencyAction.hpp 379 bytes ​ 560cbf   12 years FrederikHeber Added a DestroyAdjacencyAction with undo/redo. - also added …
SubgraphDissectionAction.cpp 3.3 KB ​ 329cf3   10 years FrederikHeber FIX: All MakroActions now have prototype_actions and copy from that. …
SubgraphDissectionAction.def 1.0 KB ​ f47e00b   11 years FrederikHeber FIX: SubgraphDissectionAction is now a MakroAction, fixed …
SubgraphDissectionAction.hpp 399 bytes ​ f47e00b   11 years FrederikHeber FIX: SubgraphDissectionAction is now a MakroAction, fixed …
UpdateMoleculesAction.cpp 5.0 KB ​ 26b4d62   11 years FrederikHeber All Actions now give correct failure status via STATUS() macro.
UpdateMoleculesAction.def 1.0 KB ​ 22b786   12 years FrederikHeber Made SubgraphDissection a MakroAction and added UpdateMoleculesAction. …
UpdateMoleculesAction.hpp 374 bytes ​ 22b786   12 years FrederikHeber Made SubgraphDissection a MakroAction and added UpdateMoleculesAction. …
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