source: src/UIElements/Views/Qt4/Qt3D/GLMoleculeObject_molecule.cpp@ 1ce04b

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 1ce04b was 3b229e, checked in by Frederik Heber <heber@…>, 13 years ago

GL: made hover/selection materials static

  • no more getMaterial(_evil_number_) workaround
  • Property mode set to 100644
File size: 3.3 KB
RevLine 
[c67518]1/*
2 * Project: MoleCuilder
3 * Description: creates and alters molecular systems
4 * Copyright (C) 2010-2012 University of Bonn. All rights reserved.
5 * Please see the LICENSE file or "Copyright notice" in builder.cpp for details.
6 */
7
8/*
9 * GLMoleculeObject_molecule.cpp
10 *
11 * Created on: Mar 30, 2012
12 * Author: ankele
13 */
14
15
16
17
18
19// include config.h
20#ifdef HAVE_CONFIG_H
21#include <config.h>
22#endif
23
24#include "GLMoleculeObject_molecule.hpp"
25
26#include <Qt3D/qglbuilder.h>
27#include <Qt3D/qglscenenode.h>
28#include <Qt3D/qglsphere.h>
29
30#include "CodePatterns/MemDebug.hpp"
31
32#include "CodePatterns/Assert.hpp"
33#include "CodePatterns/Log.hpp"
34#include "CodePatterns/Observer/Notification.hpp"
35
36#include "Atom/atom.hpp"
37#include "molecule.hpp"
38#include "Descriptors/AtomIdDescriptor.hpp"
39#include "Element/element.hpp"
40#include "LinearAlgebra/Vector.hpp"
41#include "World.hpp"
42
43static QGLSceneNode * createMolecule(QObject *parent)
44{
45 // create an empty mesh...
46 QGLBuilder builder;
47 QGLSceneNode *n = builder.finalizedSceneNode();
48 n->setParent(parent);
49 return n;
50}
51
52GLMoleculeObject_molecule::GLMoleculeObject_molecule(QObject *parent, const molecule *molref) :
53 GLMoleculeObject(createMolecule(parent), parent),
54 Observer(std::string("GLMoleculeObject_molecule")+toString(molref->getId())),
55 _molecule(molref)
56{
57 // sign on as observer (obtain non-const instance before)
58 /*molref->signOn(this, AtomObservable::IndexChanged);
59 molref->signOn(this, AtomObservable::PositionChanged);
60 molref->signOn(this, AtomObservable::ElementChanged);
61 molref->signOn(this, AtomObservable::BondsAdded);*/
62 World::getInstance().signOn(this, World::SelectionChanged);
63 setPosition(QVector3D(0,0,0));
64 setScale(5.0f);
[3b229e]65 setMaterial(getMaterial(1));
[c67518]66}
67
68GLMoleculeObject_molecule::~GLMoleculeObject_molecule()
69{
70 /*_atom->signOff(this, AtomObservable::IndexChanged);
71 _atom->signOff(this, AtomObservable::PositionChanged);
72 _atom->signOff(this, AtomObservable::ElementChanged);
73 _atom->signOff(this, AtomObservable::BondsAdded);*/
74 World::getInstance().signOff(this, World::SelectionChanged);
75}
76
77void GLMoleculeObject_molecule::update(Observable *publisher)
78{
79#ifdef LOG_OBSERVER
80 observerLog().addMessage() << "++ Update of Observer " << observerLog().getName(this) << " from atom "+toString(_atom->getId())+".";
81#endif
82}
83
84void GLMoleculeObject_molecule::subjectKilled(Observable *publisher)
85{}
86
87void GLMoleculeObject_molecule::recieveNotification(Observable *publisher, Notification_ptr notification)
88{
89 if (publisher == dynamic_cast<const Observable*>(_molecule)){
90 // notofication from atom
91#ifdef LOG_OBSERVER
92 observerLog().addMessage() << "++ Update of Observer "<< observerLog().getName(this)
93 << " received notification from molecule " << _molecule->getId() << " for channel "
94 << notification->getChannelNo() << ".";
95#endif
96 }else{
97 // notification from world
98#ifdef LOG_OBSERVER
99 observerLog().addMessage() << "++ Update of Observer "<< observerLog().getName(this)
100 << " received notification from world for channel "
101 << notification->getChannelNo() << ".";
102#endif
103 switch (notification->getChannelNo()) {
104 case World::SelectionChanged:
105 setSelected(World::getInstance().isSelected(_molecule));
106 break;
107 default:
108 break;
109 }
110 }
111}
112
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