Changeset 24fbf3 for src/Actions/SelectionAction

Timestamp:

Oct 30, 2010, 6:44:29 PM (15 years ago)

Author:

Frederik Heber <heber@…>

Branches:

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

Children:

fc192f

Parents:

2a6a2c

git-author:

Frederik Heber <heber@…> (10/26/10 10:43:36)

git-committer:

Frederik Heber <heber@…> (10/30/10 18:44:29)

Message:

All specialization of ActionTraits now contain specific information.

• new defines in Action_impl_header.hpp: DEFAULTVALUE, DESCRiPTION, SHORTFORM, TYPEINFO.
• i.e. removed the MapOfActions' short-wiring.
• script used for extraction is in src/Actions/convert.sh.
• we cause a compilation error if DESCRIPTION or TYPEINFO are missing.
• FIX: added some typeinfos as void where missing.

Location:

src/Actions/SelectionAction

Files:

• AllAtomsAction.def (modified) (1 diff)
• AllAtomsInsideCuboidAction.def (modified) (2 diffs)
• AllAtomsInsideSphereAction.def (modified) (1 diff)
• AllAtomsOfMoleculeAction.def (modified) (1 diff)
• AllMoleculesAction.def (modified) (1 diff)
• AtomByElementAction.def (modified) (1 diff)
• AtomByIdAction.def (modified) (1 diff)
• ClearAllAtomsAction.def (modified) (1 diff)
• ClearAllMoleculesAction.def (modified) (1 diff)
• MoleculeByFormulaAction.def (modified) (1 diff)
• MoleculeByIdAction.def (modified) (1 diff)
• MoleculeOfAtomAction.def (modified) (1 diff)
• NotAllAtomsAction.def (modified) (1 diff)
• NotAllAtomsInsideCuboidAction.def (modified) (2 diffs)
• NotAllAtomsInsideSphereAction.def (modified) (1 diff)
• NotAllAtomsOfMoleculeAction.def (modified) (1 diff)
• NotAllMoleculesAction.def (modified) (1 diff)
• NotAtomByElementAction.def (modified) (1 diff)
• NotAtomByIdAction.def (modified) (1 diff)
• NotMoleculeByFormulaAction.def (modified) (1 diff)
• NotMoleculeByIdAction.def (modified) (1 diff)
• NotMoleculeOfAtomAction.def (modified) (1 diff)

src/Actions/SelectionAction/AllAtomsAction.def

@@ -24 +24 @@
 #define TOKEN "select-all-atoms"
 
+
+// finally the information stored in the ActionTrait specialization
+#undef DEFAULTVALUE
+#define DESCRIPTION "select all atoms"
+#undef SHORTFORM
+#define TYPEINFO &typeid(void)

src/Actions/SelectionAction/AllAtomsInsideCuboidAction.def

@@ -7 +7 @@
 
 // all includes and forward declarations necessary for non-integral types below
+#include "Actions/Values.hpp"
+
 class Vector;
 
@@ -24 +26 @@
 #define TOKEN "select-atoms-inside-cuboid"
 
+
+// finally the information stored in the ActionTrait specialization
+#undef DEFAULTVALUE
+#define DESCRIPTION "select all atoms inside a cuboid"
+#undef SHORTFORM
+#define TYPEINFO &typeid(VectorValue)

src/Actions/SelectionAction/AllAtomsInsideSphereAction.def

@@ -24 +24 @@
 #define TOKEN "select-atoms-inside-sphere"
 
+
+// finally the information stored in the ActionTrait specialization
+#undef DEFAULTVALUE
+#define DESCRIPTION "select all atoms inside a sphere"
+#undef SHORTFORM
+#define TYPEINFO &typeid(double)

src/Actions/SelectionAction/AllAtomsOfMoleculeAction.def

@@ -24 +24 @@
 #define TOKEN "select-molecules-atoms"
 
+
+// finally the information stored in the ActionTrait specialization
+#undef DEFAULTVALUE
+#define DESCRIPTION "select all atoms of a molecule"
+#undef SHORTFORM
+#define TYPEINFO &typeid(molecule)

src/Actions/SelectionAction/AllMoleculesAction.def

@@ -23 +23 @@
 #define TOKEN "select-all-molecules"
 
+
+// finally the information stored in the ActionTrait specialization
+#undef DEFAULTVALUE
+#define DESCRIPTION "select all molecules"
+#undef SHORTFORM
+#define TYPEINFO &typeid(void)

src/Actions/SelectionAction/AtomByElementAction.def

@@ -24 +24 @@
 #define TOKEN "select-atom-by-element"
 
+
+// finally the information stored in the ActionTrait specialization
+#undef DEFAULTVALUE
+#define DESCRIPTION "select an atom by element"
+#undef SHORTFORM
+#define TYPEINFO &typeid(const element)

src/Actions/SelectionAction/AtomByIdAction.def

@@ -24 +24 @@
 #define TOKEN "select-atom-by-id"
 
+
+// finally the information stored in the ActionTrait specialization
+#undef DEFAULTVALUE
+#define DESCRIPTION "select an atom by index"
+#undef SHORTFORM
+#define TYPEINFO &typeid(atom)

src/Actions/SelectionAction/ClearAllAtomsAction.def

@@ -23 +23 @@
 #define TOKEN "clear-atom-selection"
 
+
+// finally the information stored in the ActionTrait specialization
+#undef DEFAULTVALUE
+#define DESCRIPTION "clear the atom selection"
+#undef SHORTFORM
+#define TYPEINFO &typeid(void)

src/Actions/SelectionAction/ClearAllMoleculesAction.def

@@ -23 +23 @@
 #define TOKEN "clear-molecule-selection"
 
+
+// finally the information stored in the ActionTrait specialization
+#undef DEFAULTVALUE
+#define DESCRIPTION "clear the molecule selection"
+#undef SHORTFORM
+#define TYPEINFO &typeid(void)

src/Actions/SelectionAction/MoleculeByFormulaAction.def

@@ -24 +24 @@
 #define TOKEN "select-molecule-by-formula"
 
+
+// finally the information stored in the ActionTrait specialization
+#undef DEFAULTVALUE
+#define DESCRIPTION "select a molecule by chemical formula"
+#undef SHORTFORM
+#define TYPEINFO &typeid(std::string)

src/Actions/SelectionAction/MoleculeByIdAction.def

@@ -24 +24 @@
 #define TOKEN "select-molecule-by-id"
 
+
+// finally the information stored in the ActionTrait specialization
+#undef DEFAULTVALUE
+#define DESCRIPTION "select a molecule by index"
+#undef SHORTFORM
+#define TYPEINFO &typeid(molecule)

src/Actions/SelectionAction/MoleculeOfAtomAction.def

@@ -23 +23 @@
 #define TOKEN "select-molecule-of-atom"
 
+
+// finally the information stored in the ActionTrait specialization
+#undef DEFAULTVALUE
+#define DESCRIPTION "select a molecule to which a given atom belongs"
+#undef SHORTFORM
+#define TYPEINFO &typeid(atom)

src/Actions/SelectionAction/NotAllAtomsAction.def

@@ -24 +24 @@
 #define TOKEN "unselect-all-atoms"
 
+
+// finally the information stored in the ActionTrait specialization
+#undef DEFAULTVALUE
+#define DESCRIPTION "unselect all atoms"
+#undef SHORTFORM
+#define TYPEINFO &typeid(void)

src/Actions/SelectionAction/NotAllAtomsInsideCuboidAction.def

@@ -7 +7 @@
 
 // all includes and forward declarations necessary for non-integral types below
+#include "Actions/Values.hpp"
+
 class Vector;
 
@@ -24 +26 @@
 #define TOKEN "unselect-atoms-inside-cuboid"
 
+
+// finally the information stored in the ActionTrait specialization
+#undef DEFAULTVALUE
+#define DESCRIPTION "unselect all atoms inside a cuboid"
+#undef SHORTFORM
+#define TYPEINFO &typeid(VectorValue)

src/Actions/SelectionAction/NotAllAtomsInsideSphereAction.def

@@ -24 +24 @@
 #define TOKEN "unselect-atoms-inside-sphere"
 
+
+// finally the information stored in the ActionTrait specialization
+#undef DEFAULTVALUE
+#define DESCRIPTION "unselect all atoms inside a sphere"
+#undef SHORTFORM
+#define TYPEINFO &typeid(double)

src/Actions/SelectionAction/NotAllAtomsOfMoleculeAction.def

@@ -24 +24 @@
 #define TOKEN "unselect-molecules-atoms"
 
+
+// finally the information stored in the ActionTrait specialization
+#undef DEFAULTVALUE
+#define DESCRIPTION "unselect all atoms of a molecule"
+#undef SHORTFORM
+#define TYPEINFO &typeid(molecule)

src/Actions/SelectionAction/NotAllMoleculesAction.def

@@ -23 +23 @@
 #define TOKEN "unselect-all-molecules"
 
+
+// finally the information stored in the ActionTrait specialization
+#undef DEFAULTVALUE
+#define DESCRIPTION "unselect all molecules"
+#undef SHORTFORM
+#define TYPEINFO &typeid(void)

src/Actions/SelectionAction/NotAtomByElementAction.def

@@ -24 +24 @@
 #define TOKEN "unselect-atom-by-element"
 
+
+// finally the information stored in the ActionTrait specialization
+#undef DEFAULTVALUE
+#define DESCRIPTION "unselect an atom by element"
+#undef SHORTFORM
+#define TYPEINFO &typeid(const element)

src/Actions/SelectionAction/NotAtomByIdAction.def

@@ -24 +24 @@
 #define TOKEN "unselect-atom-by-id"
 
+
+// finally the information stored in the ActionTrait specialization
+#undef DEFAULTVALUE
+#define DESCRIPTION "unselect an atom by index"
+#undef SHORTFORM
+#define TYPEINFO &typeid(atom)

src/Actions/SelectionAction/NotMoleculeByFormulaAction.def

@@ -24 +24 @@
 #define TOKEN "unselect-molecule-by-formula"
 
+
+// finally the information stored in the ActionTrait specialization
+#undef DEFAULTVALUE
+#define DESCRIPTION "unselect a molecule by chemical formula"
+#undef SHORTFORM
+#define TYPEINFO &typeid(std::string)

src/Actions/SelectionAction/NotMoleculeByIdAction.def

@@ -24 +24 @@
 #define TOKEN "unselect-molecule-by-id"
 
+
+// finally the information stored in the ActionTrait specialization
+#undef DEFAULTVALUE
+#define DESCRIPTION "unselect a molecule by index"
+#undef SHORTFORM
+#define TYPEINFO &typeid(molecule)

src/Actions/SelectionAction/NotMoleculeOfAtomAction.def

@@ -23 +23 @@
 #define TOKEN "unselect-molecule-of-atom"
 
+
+// finally the information stored in the ActionTrait specialization
+#undef DEFAULTVALUE
+#define DESCRIPTION "unselect a molecule to which a given atom belongs"
+#undef SHORTFORM
+#define TYPEINFO &typeid(atom)