source: src/Actions@ 5be0eb

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
../
Action.cpp 407 bytes ​ e73a8a2   15 years Till Crueger Changed ActionRegistry to use the new Singleton Mechanism
Action.hpp 730 bytes ​ bfce50   15 years Till Crueger Moved method to rename molecules to a seperate Action
ActionRegistry.cpp 1.0 KB ​ e73a8a2   15 years Till Crueger Changed ActionRegistry to use the new Singleton Mechanism
ActionRegistry.hpp 567 bytes ​ e73a8a2   15 years Till Crueger Changed ActionRegistry to use the new Singleton Mechanism
ActionSequence.cpp 1013 bytes ​ 1fa107   15 years Till Crueger Added an action that allows grouping and grouped execution of several …
ActionSequence.hpp 488 bytes ​ a5041ec   15 years Till Crueger Added mechanism that allow to store and later execute sequences of Actions.
AtomsCalculation.hpp 549 bytes ​ b54ac8   15 years Till Crueger Added templates that allow arbitrary calculations on atoms to be …
AtomsCalculation_impl.hpp 1.0 KB ​ 6e97e5   15 years Till Crueger Added a generic Iterator that can be used to iterate only over certain …
Calculation.hpp 1.5 KB ​ dbb474   15 years Till Crueger Improved Doxygen documentation
Calculation_impl.hpp 1.2 KB ​ ead4e6   15 years Till Crueger Made the periodentafel use STL-containers instead of custom llists
ErrorAction.cpp 518 bytes ​ cc04b7   15 years Till Crueger Added a central registry that allows access to actions by name.
ErrorAction.hpp 472 bytes ​ cc04b7   15 years Till Crueger Added a central registry that allows access to actions by name.
MakroAction.cpp 665 bytes ​ 24a5e0   15 years Till Crueger Added -Wall flag and fixed several small hickups
MakroAction.hpp 663 bytes ​ cc04b7   15 years Till Crueger Added a central registry that allows access to actions by name.
ManipulateAtomsProcess.cpp 971 bytes ​ 6e97e5   15 years Till Crueger Added a generic Iterator that can be used to iterate only over certain …
ManipulateAtomsProcess.hpp 740 bytes ​ 6e97e5   15 years Till Crueger Added a generic Iterator that can be used to iterate only over certain …
MethodAction.cpp 575 bytes ​ cc04b7   15 years Till Crueger Added a central registry that allows access to actions by name.
MethodAction.hpp 659 bytes ​ cc04b7   15 years Till Crueger Added a central registry that allows access to actions by name.
Process.cpp 1.8 KB ​ dbb474   15 years Till Crueger Improved Doxygen documentation
Process.hpp 2.2 KB ​ dbb474   15 years Till Crueger Improved Doxygen documentation
small_actions.cpp 1.1 KB ​ d7940e   15 years Till Crueger Made the UIFactory an instance of the Singleton Pattern
small_actions.hpp 570 bytes ​ 0188ea   15 years Till Crueger Added a progress indicator for the text menu
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