source: src/Actions@ 52575c

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
../
WorldAction 1887bb   12 years ankele drop compatibility for old boost version (filesystem)
unittests 5ca6b5   12 years ankele drop deprecated references to ValueStorage
TesselationAction 6ba9ba   13 years FrederikHeber Default values are properly set by the Action into their …
SelectionAction 6ba9ba   13 years FrederikHeber Default values are properly set by the Action into their …
RandomNumbersAction 6ba9ba   13 years FrederikHeber Default values are properly set by the Action into their …
ParserAction 5ca6b5   12 years ankele drop deprecated references to ValueStorage
MoleculeAction 1887bb   12 years ankele drop compatibility for old boost version (filesystem)
GraphAction 6ba9ba   13 years FrederikHeber Default values are properly set by the Action into their …
FragmentationAction edecba   12 years FrederikHeber Added Action to use the JobMarket for FragmentationAutomation. - …
FillAction cbe40b   12 years ankele FillSphericalSurfaceAction use VectorNotZeroValidator for axis
CommandAction 6ba9ba   13 years FrederikHeber Default values are properly set by the Action into their …
AtomAction 1887bb   12 years ankele drop compatibility for old boost version (filesystem)
AnalysisAction 6ba9ba   13 years FrederikHeber Default values are properly set by the Action into their …
Values.hpp 1.0 KB ​ 7d9416   13 years FrederikHeber Turned query<Box> into query<RealSpaceMatrix> - CenterInBox and …
Values.cpp 1.2 KB ​ 7d9416   13 years FrederikHeber Turned query<Box> into query<RealSpaceMatrix> - CenterInBox and …
UndoRedoHelpers.hpp 2.2 KB ​ 8ea3e7   13 years FrederikHeber CopyMolecule can now copy all currently selected molecules. - this is …
UndoRedoHelpers.cpp 4.2 KB ​ 8ea3e7   13 years FrederikHeber CopyMolecule can now copy all currently selected molecules. - this is …
UndoAction.hpp 327 bytes ​ e4afb4   14 years FrederikHeber Huge refactoring: Introduction of Traits to Actions. This change is …
UndoAction.def 861 bytes ​ 6ba9ba   13 years FrederikHeber Default values are properly set by the Action into their …
UndoAction.cpp 1.3 KB ​ 0aa122   13 years FrederikHeber Updated all source files's copyright note to current year 2012.
test.sh 735 bytes ​ 649aaa   13 years FrederikHeber All Actions' .def files now have a paramvalids that is used to for …
RedoAction.hpp 327 bytes ​ e4afb4   14 years FrederikHeber Huge refactoring: Introduction of Traits to Actions. This change is …
RedoAction.def 865 bytes ​ 6ba9ba   13 years FrederikHeber Default values are properly set by the Action into their …
RedoAction.cpp 1.3 KB ​ 0aa122   13 years FrederikHeber Updated all source files's copyright note to current year 2012.
Reaction_impl_pre.hpp 7.2 KB ​ 5ca6b5   12 years ankele drop deprecated references to ValueStorage
Reaction_impl_header.hpp 7.3 KB ​ 5ca6b5   12 years ankele drop deprecated references to ValueStorage
Reaction_impl.hpp 1.6 KB ​ 1540859   13 years FrederikHeber Added Reaction as Action with a return value. - this is derived from …
Reaction.hpp 1.9 KB ​ 5ca6b5   12 years ankele drop deprecated references to ValueStorage
pyMoleCuilder.cpp 4.3 KB ​ 0aa122   13 years FrederikHeber Updated all source files's copyright note to current year 2012.
Process.hpp 2.3 KB ​ 02ce36   13 years FrederikHeber We now require CodePatterns 1.2.0. - this is due to the updated …
Process.cpp 2.2 KB ​ 0aa122   13 years FrederikHeber Updated all source files's copyright note to current year 2012.
OptionTrait.hpp 1.4 KB ​ d41313   13 years FrederikHeber Added output operators for both ActionTraits and OptionTrait.
OptionTrait.cpp 4.3 KB ​ 0aa122   13 years FrederikHeber Updated all source files's copyright note to current year 2012.
OptionRegistry.hpp 954 bytes ​ ce7fdc   13 years FrederikHeber HUGE: All Action-related codes resides now in namespace MoleCuilder. …
OptionRegistry.cpp 3.9 KB ​ 0aa122   13 years FrederikHeber Updated all source files's copyright note to current year 2012.
MethodAction.hpp 984 bytes ​ 5ca6b5   12 years ankele drop deprecated references to ValueStorage
MethodAction.cpp 1.4 KB ​ 5ca6b5   12 years ankele drop deprecated references to ValueStorage
ManipulateAtomsProcess.hpp 1.0 KB ​ 5ca6b5   12 years ankele drop deprecated references to ValueStorage
ManipulateAtomsProcess.cpp 1.9 KB ​ 5ca6b5   12 years ankele drop deprecated references to ValueStorage
MakroAction.hpp 958 bytes ​ 5ca6b5   12 years ankele drop deprecated references to ValueStorage
MakroAction.cpp 2.2 KB ​ 5ca6b5   12 years ankele drop deprecated references to ValueStorage
Makefile.am 24.0 KB ​ a55e6f   12 years ankele really remove ValueStorage
GlobalListOfActions.hpp 3.5 KB ​ 5bcbc7   12 years ankele OutputAction added
ErrorAction.hpp 760 bytes ​ 5ca6b5   12 years ankele drop deprecated references to ValueStorage
ErrorAction.cpp 1.3 KB ​ 5ca6b5   12 years ankele drop deprecated references to ValueStorage
Calculation_impl.hpp 1.6 KB ​ 5ca6b5   12 years ankele drop deprecated references to ValueStorage
Calculation.hpp 1.8 KB ​ 5ca6b5   12 years ankele drop deprecated references to ValueStorage
AtomsCalculation_impl.hpp 1.3 KB ​ 3139b2   13 years FrederikHeber Renamed ActionTrait and ActionTraits. - the specialized Trait …
AtomsCalculation.hpp 717 bytes ​ 3139b2   13 years FrederikHeber Renamed ActionTrait and ActionTraits. - the specialized Trait …
ActionTraits.hpp 798 bytes ​ 3139b2   13 years FrederikHeber Renamed ActionTrait and ActionTraits. - the specialized Trait …
ActionTrait.hpp 1.8 KB ​ 3139b2   13 years FrederikHeber Renamed ActionTrait and ActionTraits. - the specialized Trait …
ActionTrait.cpp 5.1 KB ​ 955b91   13 years FrederikHeber FIX: Removed using namespace std in Vector.hpp. - this caused some …
ActionSequence.hpp 894 bytes ​ ce7fdc   13 years FrederikHeber HUGE: All Action-related codes resides now in namespace MoleCuilder. …
ActionSequence.cpp 3.8 KB ​ 955b91   13 years FrederikHeber FIX: Removed using namespace std in Vector.hpp. - this caused some …
ActionRegistry.hpp 1.7 KB ​ 2aad5a   13 years FrederikHeber FIX: ActionRegistry now sets flag completely_instantiated when after …
ActionRegistry.cpp 2.8 KB ​ 2aad5a   13 years FrederikHeber FIX: ActionRegistry now sets flag completely_instantiated when after …
ActionHistory.hpp 1.3 KB ​ ce7fdc   13 years FrederikHeber HUGE: All Action-related codes resides now in namespace MoleCuilder. …
ActionHistory.cpp 2.3 KB ​ b7b752   12 years ankele don't undo/redo when there's nothing to undo/redo
ActionExceptions.hpp 864 bytes ​ e5c233   13 years FrederikHeber FIX: replaced boost/exception.hpp by boost/exception/all.hpp.
Action_impl_undef.hpp 463 bytes ​ 649aaa   13 years FrederikHeber All Actions' .def files now have a paramvalids that is used to for …
Action_impl_python.hpp 4.5 KB ​ 5ca6b5   12 years ankele drop deprecated references to ValueStorage
Action_impl_pre.hpp 11.3 KB ​ 6ba9ba   13 years FrederikHeber Default values are properly set by the Action into their …
Action_impl_header.hpp 8.1 KB ​ 5ca6b5   12 years ankele drop deprecated references to ValueStorage
Action.hpp 9.7 KB ​ 5ca6b5   12 years ankele drop deprecated references to ValueStorage
Action.cpp 6.6 KB ​ 5ca6b5   12 years ankele drop deprecated references to ValueStorage
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