source: src/UIElements/Views/Qt4/Qt3D/GLMoleculeObject_atom.hpp@ abb641

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 abb641 was 89b992, checked in by Frederik Heber <heber@…>, 12 years ago

GLWorldView now listens to World::TimeChanged() and updates view.

  • GLMoleculeObject_atom also listen to World::TimeChanged, required such that positions are updated, too. (Bonds are re-created, hence automatically updated).
  • Property mode set to 100644
File size: 1.2 KB
Line 
1/*
2 * GLMoleculeObject_atom.hpp
3 *
4 * Created on: Aug 17, 2011
5 * Author: heber
6 */
7
8#ifndef GLMOLECULEOBJECT_ATOM_HPP_
9#define GLMOLECULEOBJECT_ATOM_HPP_
10
11// include config.h
12#ifdef HAVE_CONFIG_H
13#include <config.h>
14#endif
15
16#include "GLMoleculeObject.hpp"
17
18#include "CodePatterns/Observer/Observer.hpp"
19
20#include "Bond/bond.hpp"
21#include "GLMoleculeObject_bond.hpp"
22
23class atom;
24
25class GLMoleculeObject_atom : public GLMoleculeObject, public Observer
26{
27 Q_OBJECT
28public:
29 GLMoleculeObject_atom(QGLSceneNode *mesh[], QObject *parent, const atom *atomref);
30 virtual ~GLMoleculeObject_atom();
31
32 // Observer functions
33 void update(Observable *publisher);
34 void subjectKilled(Observable *publisher);
35 void recieveNotification(Observable *publisher, Notification_ptr notification);
36
37private slots:
38 void wasClicked();
39
40signals:
41 void clicked(atomId_t);
42 void BondsInserted(const bond::ptr _bond, const GLMoleculeObject_bond::SideOfBond side);
43 void indexChanged(GLMoleculeObject_atom *ob, int oldId, int newId);
44
45public:
46 void resetPosition();
47
48private:
49 void resetElement();
50 void resetIndex();
51 void resetProperties();
52
53 const atom *_atom;
54};
55
56
57
58#endif /* GLMOLECULEOBJECT_ATOM_HPP_ */
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