Changeset 97ebf8 for src/UIElements/Dialog.hpp

Timestamp:

May 15, 2010, 5:56:57 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:

99fcaf, f941b1

Parents:

498c519

git-author:

Frederik Heber <heber@…> (05/14/10 20:14:27)

git-committer:

Frederik Heber <heber@…> (05/15/10 17:56:57)

Message:

Added all commands defined in ParseCommandLineOptions() as Actions.

• Actions are not yet used, except verbose, version and help.
• Files are present and included in Makefile.am
• not unit tests written so far
• no action has been tested so far (except for MapOfActions)
• structure introduced to to transition from ParseCommandLineOptions to actions.
• program name and config file are fixed arguments.

Signed-off-by: Frederik Heber <heber@…>

File:

• src/UIElements/Dialog.hpp (modified) (6 diffs)

src/UIElements/Dialog.hpp

@@ -12 +12 @@
 #include<list>
 
-class MoleculeListClass;
+class atom;
+class element;
 class molecule;
 class Vector;
-class element;
 
 class Dialog
@@ -24 +24 @@
 
   virtual void queryEmpty(const char *, std::string = "")=0;
+  virtual void queryBoolean(const char *, bool *, std::string = "")=0;
   virtual void queryInt(const char *, int *, std::string = "")=0;
   virtual void queryDouble(const char*,double *, std::string = "")=0;
   virtual void queryString(const char*, std::string *, std::string = "")=0;
-  virtual void queryMolecule(const char*,molecule**,MoleculeListClass*, std::string = "")=0;
+  virtual void queryAtom(const char*,atom**,std::string = "")=0;
+  virtual void queryMolecule(const char*,molecule**, std::string = "")=0;
   virtual void queryVector(const char*,Vector *,const double *const,bool, std::string = "")=0;
+  virtual void queryBox(const char*,double ** const, std::string = "")=0;
   virtual void queryElement(const char*,const element **, std::string = "")=0;
 
@@ -69 +72 @@
 
   //Specialized classes for certain types. GUI-Types are not specialized at this time
+  class BooleanQuery : public Query {
+  public:
+    BooleanQuery(std::string title,bool *_target, std::string _description = "");
+    virtual ~BooleanQuery();
+    virtual bool handle()=0;
+    virtual void setResult();
+  protected:
+    bool tmp;
+  private:
+    bool *target;
+  };
+
   class IntQuery : public Query {
   public:
@@ -105 +120 @@
   };
 
-
   class MoleculeQuery : public Query {
   public:
-    MoleculeQuery(std::string title, molecule **_target, MoleculeListClass *_molecules, std::string _description = "");
+    MoleculeQuery(std::string title, molecule **_target, std::string _description = "");
     virtual ~MoleculeQuery();
     virtual bool handle()=0;
@@ -114 +128 @@
   protected:
     molecule *tmp;
-    MoleculeListClass *molecules;
   private:
     molecule **target;
+  };
+
+  class AtomQuery : public Query {
+  public:
+    AtomQuery(std::string title, atom **_target, std::string _description = "");
+    virtual ~AtomQuery();
+    virtual bool handle()=0;
+    virtual void setResult();
+  protected:
+    atom *tmp;
+  private:
+    atom **target;
   };
 
@@ -131 +156 @@
     private:
       Vector *target;
+  };
+
+  class BoxQuery : public Query {
+  public:
+      BoxQuery(std::string title,double ** const _cellSize, std::string _description = "");
+      virtual ~BoxQuery();
+      virtual bool handle()=0;
+      virtual void setResult();
+    protected:
+      double *tmp;
+    private:
+      double **target;
   };