Changeset 63fb7a for src/UIElements
- Timestamp:
- Jul 24, 2015, 4:44:34 PM (10 years ago)
- 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:
- 1259df
- Parents:
- 795c0f
- git-author:
- Frederik Heber <heber@…> (06/01/15 08:48:35)
- git-committer:
- Frederik Heber <heber@…> (07/24/15 16:44:34)
- Location:
- src/UIElements
- Files:
-
- 8 edited
Legend:
- Unmodified
- Added
- Removed
-
src/UIElements/CommandLineUI/Query/MoleculesCommandLineQuery.cpp
r795c0f r63fb7a 61 61 } 62 62 for (std::vector<int>::iterator iter = IdxOfMol.begin(); iter != IdxOfMol.end(); ++iter) { 63 const molecule *temp_element = World::getInstance().getMolecule(MoleculeById(*iter)); 63 const molecule *temp_element = const_cast<const World &>(World::getInstance()). 64 getMolecule(MoleculeById(*iter)); 64 65 if (temp_element) 65 66 temp.push_back(temp_element); -
src/UIElements/Views/Qt4/MoleculeList/QtMoleculeItem.cpp
r795c0f r63fb7a 71 71 void QtMoleculeItem::signOnToMolecule() 72 72 { 73 const molecule *mol = World::getInstance().getMolecule(MoleculeById(molid)); 73 const molecule * const mol = const_cast<const World &>(World::getInstance()). 74 getMolecule(MoleculeById(molid)); 74 75 if (mol != NULL) { 75 76 if (!IsSignedOn) … … 83 84 void QtMoleculeItem::signOffFromMolecule() 84 85 { 85 const molecule *mol = World::getInstance().getMolecule(MoleculeById(molid)); 86 const molecule * const mol = const_cast<const World &>(World::getInstance()). 87 getMolecule(MoleculeById(molid)); 86 88 if (mol != NULL) { 87 89 if (IsSignedOn) … … 140 142 const molecule * const QtMoleculeItem::getMolecule() const 141 143 { 142 const molecule * mol = World::getInstance().getMolecule(MoleculeById(molid));144 const molecule * const mol = const_cast<const World &>(World::getInstance()).getMolecule(MoleculeById(molid)); 143 145 ASSERT (mol != NULL, 144 146 "QtMoleculeItem::getMolecule() - mol with "+toString(molid)+" is gone."); -
src/UIElements/Views/Qt4/MoleculeList/QtMoleculeList.cpp
r795c0f r63fb7a 578 578 QtMoleculeItemFactory::NAME)); 579 579 const moleculeId_t molid = ItemToMoleculeId(_item); 580 const molecule *mol = World::getInstance().getMolecule(MoleculeById(molid)); 580 const molecule *mol = const_cast<const World &>(World::getInstance()). 581 getMolecule(MoleculeById(molid)); 581 582 if (std::binary_search( 582 583 toBeRemovedItems_copy.begin(), toBeRemovedItems_copy.end(), … … 624 625 // LOG(1, "Adding molecule " << (*moliter)->getName()); 625 626 // check that World knows the molecule still 626 const molecule * const mol = 627 World::getInstance().getMolecule(MoleculeById((*moliter)->getId()));627 const molecule * const mol = const_cast<const World &>(World::getInstance()). 628 getMolecule(MoleculeById((*moliter)->getId())); 628 629 if ((mol != NULL) && (mol == *moliter)) { 629 630 addMolecule(mol); -
src/UIElements/Views/Qt4/MoleculeList/SpecificItems/QtMoleculeItem_atomcount.hpp
r795c0f r63fb7a 44 44 void internal_updateState() 45 45 { 46 const molecule * mol = World::getInstance().getMolecule(MoleculeById(molid)); 46 const molecule * mol = const_cast<const World &>(World::getInstance()). 47 getMolecule(MoleculeById(molid)); 47 48 if (mol != NULL) 48 49 setText(QString::number(mol->getAtomCount())); -
src/UIElements/Views/Qt4/MoleculeList/SpecificItems/QtMoleculeItem_formula.hpp
r795c0f r63fb7a 47 47 void internal_updateState() 48 48 { 49 const molecule * mol = World::getInstance().getMolecule(MoleculeById(molid)); 49 const molecule * mol = const_cast<const World &>(World::getInstance()). 50 getMolecule(MoleculeById(molid)); 50 51 if (mol != NULL) 51 52 setText(QString(mol->getFormula().toString().c_str())); -
src/UIElements/Views/Qt4/MoleculeList/SpecificItems/QtMoleculeItem_name.hpp
r795c0f r63fb7a 44 44 void internal_updateState() 45 45 { 46 const molecule * mol = World::getInstance().getMolecule(MoleculeById(molid)); 46 const molecule * mol = const_cast<const World &>(World::getInstance()). 47 getMolecule(MoleculeById(molid)); 47 48 if (mol != NULL) 48 49 setText(QString(mol->getName().c_str())); -
src/UIElements/Views/Qt4/Qt3D/GLMoleculeObject_molecule.cpp
r795c0f r63fb7a 69 69 static QGLSceneNode *createMoleculeMesh(const moleculeId_t molid, QObject *parent) 70 70 { 71 const molecule *molref = World::getInstance().getMolecule(MoleculeById(molid)); 71 const molecule *molref = const_cast<const World &>(World::getInstance()). 72 getMolecule(MoleculeById(molid)); 72 73 if (molref == NULL) { 73 74 ELOG(1, "Could not createMoleculeMesh, molecule with id " << molid << " already gone."); … … 156 157 { 157 158 // sign on as observer (obtain non-const instance before) 158 const molecule *_molecule = World::getInstance().getMolecule(MoleculeById(moleculeid)); 159 const molecule *_molecule = const_cast<const World &>(World::getInstance()). 160 getMolecule(MoleculeById(moleculeid)); 159 161 if (_molecule != NULL) { 160 162 _molecule->signOn(this, molecule::AtomInserted); … … 194 196 { 195 197 // sign on as observer (obtain non-const instance before) 196 const molecule *_molecule = World::getInstance().getMolecule(MoleculeById(moleculeid)); 198 const molecule *_molecule = const_cast<const World &>(World::getInstance()). 199 getMolecule(MoleculeById(moleculeid)); 197 200 if (_molecule != NULL) { 198 201 _molecule->signOn(this, molecule::AtomInserted); … … 225 228 { 226 229 if (isSignedOn) { 227 const molecule *_molecule = World::getInstance().getMolecule(MoleculeById(moleculeid)); 230 const molecule *_molecule = const_cast<const World &>(World::getInstance()). 231 getMolecule(MoleculeById(moleculeid)); 228 232 if (_molecule != NULL) { 229 233 _molecule->signOff(this, molecule::AtomInserted); … … 247 251 void GLMoleculeObject_molecule::init() 248 252 { 249 const molecule *_molecule = World::getInstance().getMolecule(MoleculeById(moleculeid)); 253 const molecule * const _molecule = const_cast<const World &>(World::getInstance()). 254 getMolecule(MoleculeById(moleculeid)); 250 255 if (_molecule == NULL) { 251 256 ELOG(1, "GLMoleculeObject_molecule cannot init, molecule with " … … 320 325 void GLMoleculeObject_molecule::reinit() 321 326 { 322 const molecule *_molecule = World::getInstance().getMolecule(MoleculeById(moleculeid)); 327 const molecule * const _molecule = const_cast<const World &>(World::getInstance()). 328 getMolecule(MoleculeById(moleculeid)); 323 329 if (_molecule == NULL) { 324 330 ELOG(1, "GLMoleculeObject_molecule cannot reinit, molecule with " … … 348 354 { 349 355 isBoundingBoxUptodate = true; 350 const molecule *_molecule = World::getInstance().getMolecule(MoleculeById(moleculeid)); 356 const molecule * const _molecule = const_cast<const World &>(World::getInstance()). 357 getMolecule(MoleculeById(moleculeid)); 351 358 if (_molecule == NULL) { 352 359 ELOG(1, "GLMoleculeObject_molecule cannot updateBoundingBox, molecule with " … … 375 382 void GLMoleculeObject_molecule::recieveNotification(Observable *publisher, Notification_ptr notification) 376 383 { 377 const molecule *_molecule = World::getInstance().getMolecule(MoleculeById(moleculeid)); 384 const molecule * const _molecule = const_cast<const World &>(World::getInstance()). 385 getMolecule(MoleculeById(moleculeid)); 378 386 if (publisher == dynamic_cast<const Observable*>(_molecule)){ 379 387 // notofication from atom -
src/UIElements/Views/Qt4/Qt3D/GLWorldScene.cpp
r795c0f r63fb7a 162 162 { 163 163 LOG(3, "INFO: GLMoleculeObject_molecule - mol " << no << " has been clicked."); 164 const molecule *mol= World::getInstance().getMolecule(MoleculeById(no)); 164 const molecule * const mol= const_cast<const World &>(World::getInstance()). 165 getMolecule(MoleculeById(no)); 165 166 ASSERT(mol, "Atom without molecule has been clicked."); 166 167 molids_t ids(1, mol->getId());
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