source: src/UIElements/Views/Qt4/Qt3D/GLWorldScene.hpp@ c73e35

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
Last change on this file since c73e35 was beadd0, checked in by Frederik Heber <heber@…>, 11 years ago

Changed atom ptr into atomicId_t param for atomInserted of GLWorld... classes.

  • Property mode set to 100644
File size: 3.1 KB
Line 
1/*
2 * GLWorldScene.hpp
3 *
4 * This is based on the Qt3D example "teaservice", specifically parts of teaservice.cpp.
5 *
6 * Created on: Aug 17, 2011
7 * Author: heber
8 */
9
10#ifndef GLWORLDSCENE_HPP_
11#define GLWORLDSCENE_HPP_
12
13// include config.h
14#ifdef HAVE_CONFIG_H
15#include <config.h>
16#endif
17
18#include <Qt/qobject.h>
19
20#include <iosfwd>
21
22#include "Bond/bond.hpp"
23#include "GLMoleculeObject_bond.hpp"
24#include "GLMoleculeObject_molecule.hpp"
25#include "types.hpp"
26
27class atom;
28class molecule;
29class Shape;
30
31class QGLPainter;
32class QGLSceneNode;
33class QGLView;
34
35class GLMoleculeObject;
36class GLMoleculeObject_atom;
37class GLMoleculeObject_molecule;
38class GLMoleculeObject_shape;
39
40/** This class contains a list of all molecules in the world.
41 *
42 */
43class GLWorldScene : public QObject
44{
45 Q_OBJECT
46public:
47 GLWorldScene(QObject *parent=0);
48 virtual ~GLWorldScene();
49
50//#if !defined(QT_OPENGL_ES_1)
51// PerPixelEffect *lighting;
52//#endif
53
54 void changeMaterials(bool perPixel);
55 QGLSceneNode* getAtom(size_t);
56 QGLSceneNode* getMolecule(size_t);
57 QGLSceneNode* getBond(size_t, size_t);
58
59 void initialize(QGLView *view, QGLPainter *painter) const;
60 void draw(QGLPainter *painter, const QVector4D &cameraPlane) const;
61
62 enum SelectionModeType{
63 SelectAtom,
64 SelectMolecule
65 };
66 void setSelectionMode(SelectionModeType mode);
67
68signals:
69 void changed();
70 void changeOccured();
71 void pressed();
72 void released();
73 void clicked();
74 void clicked(atomId_t);
75 void doubleClicked();
76 void hoverChanged(const atom*);
77
78private slots:
79 void atomClicked(atomId_t no);
80 void atomInserted(const atomicNumber_t _id);
81 void atomRemoved(const atomicNumber_t _id);
82 void moleculeRemoved(const molecule *_molecule);
83 void worldSelectionChanged();
84 void bondInserted(const bond::ptr _bond, const GLMoleculeObject_bond::SideOfBond side);
85 void bondRemoved(const atomId_t leftnr, const atomId_t rightnr);
86 void setSelectionModeAtom();
87 void setSelectionModeMolecule();
88 void hoverChangedSignalled(GLMoleculeObject *ob);
89 void changeAtomId(GLMoleculeObject_atom *ob, int oldId, int newOd);
90 void addShape();
91 void removeShape();
92
93public:
94 void updateSelectedShapes();
95
96private:
97 void init();
98
99private:
100 typedef std::pair< atomId_t, atomId_t> BondIds;
101 friend std::ostream &operator<<(std::ostream &ost, const BondIds &t);
102
103 typedef std::map< atomId_t, GLMoleculeObject_atom* > AtomNodeMap;
104 typedef std::map< BondIds , GLMoleculeObject_bond* > BondNodeMap;
105 typedef std::map< moleculeId_t , GLMoleculeObject_molecule* > MoleculeNodeMap;
106 typedef std::map< std::string , GLMoleculeObject_shape* > ShapeNodeMap;
107 AtomNodeMap AtomsinSceneMap;
108 BondNodeMap BondsinSceneMap;
109 MoleculeNodeMap MoleculesinSceneMap;
110 ShapeNodeMap ShapesinSceneMap;
111
112 QGLSceneNode *meshEmpty[GLMoleculeObject::DETAILTYPES_MAX];
113 QGLSceneNode *meshSphere[GLMoleculeObject::DETAILTYPES_MAX];
114 QGLSceneNode *meshCylinder[GLMoleculeObject::DETAILTYPES_MAX];
115
116 SelectionModeType selectionMode;
117 const atom *hoverAtom;
118};
119
120std::ostream &operator<<(std::ostream &ost, const GLWorldScene::BondIds &t);
121
122#endif /* GLWORLDSCENE_HPP_ */
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