Changeset 6d1e0a for src/UIElements/Views/Qt4/MoleculeList/QtMoleculeItemFactory.hpp

Timestamp:

Jan 28, 2015, 7:07:01 PM (10 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:

53c1ff

Parents:

bed759

git-author:

Frederik Heber <heber@…> (01/18/15 13:33:42)

git-committer:

Frederik Heber <heber@…> (01/28/15 19:07:01)

Message:

Added a slew of specific QtMoleculeItem for each of the COLUMNs.

• all are produced solely by the factory and are very specific.

File:

• src/UIElements/Views/Qt4/MoleculeList/QtMoleculeItemFactory.hpp (modified) (1 diff)

src/UIElements/Views/Qt4/MoleculeList/QtMoleculeItemFactory.hpp

@@ -14 +14 @@
 #endif
 
-class QtMoleculeItemFactory
+#include "CodePatterns/Singleton.hpp"
+
+#include <QList>
+
+#include <string>
+
+class molecule;
+
+#include "UIElements/Views/Qt4/MoleculeList/QtMoleculeItem.hpp"
+
+/** This class is a factory for a list of QtMoleculeItem's.
+ *
+ * QtMoleculeList contains these per row, either a group item which combines
+ * molecules of the same formula, or a molecule item which represents a single
+ * molecule.
+ */
+class QtMoleculeItemFactory : public Singleton<QtMoleculeItemFactory>
 {
+  //!> grant Singleton access to cstor and dstor.
+  friend class Singleton<QtMoleculeItemFactory>;
+private:
+  // private constructor and destructor due to singleton
+  QtMoleculeItemFactory();
+  virtual ~QtMoleculeItemFactory() {}
 
+public:
+  static const int COLUMNCOUNT;
+  enum {NAME,VISIBILITY,ATOMCOUNT,FORMULA,OCCURRENCE,COLUMNTYPES_MAX} COLUMNTYPES;
+  static const char *COLUMNNAMES[];
+
+  /** Creates all QtMoleculeItem's that make up the row for a single molecule.
+   *
+   * \param _mol ref to molecule which is stored internally
+   * \param _emitDirtyState callback function to model to inform about required state update
+   * \return list of prepared items to be appended to a group item
+   */
+  QList<QStandardItem *> createMoleculeItems(
+      const molecule *_mol,
+      const QtMoleculeItem::emitDirtyState_t &_emitDirtyState);
+
+  /** Creates all QtMoleculeItem's that make up a row of a group item.
+   *
+   * \param _formula chemical formula which describes all molecules in this group
+   * \return list of prepared items to be appended to the invisibleRootItem()
+   */
+  QList<QStandardItem *> createGroupItems(const std::string &_formula);
 };