Changeset 455043 for src/LinkedCell
- Timestamp:
- Jan 2, 2012, 1:34:57 PM (13 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:
- c29915
- Parents:
- 54f3d1
- git-author:
- Frederik Heber <heber@…> (12/21/11 17:57:51)
- git-committer:
- Frederik Heber <heber@…> (01/02/12 13:34:57)
- Location:
- src/LinkedCell
- Files:
-
- 2 edited
Legend:
- Unmodified
- Added
- Removed
-
src/LinkedCell/LinkedCell_Controller.cpp
r54f3d1 r455043 139 139 * @param instance pointer to model 140 140 */ 141 void LinkedCell_Controller::insertNewModel(const double edgelength, LinkedCell_Model*&instance)141 void LinkedCell_Controller::insertNewModel(const double edgelength, const LinkedCell_Model* instance) 142 142 { 143 143 std::pair< MapEdgelengthModel::iterator, bool> inserter = … … 160 160 { 161 161 /// Look for best instance. 162 const LinkedCell_Model * LCModel_best = getBestModel(distance);162 const LinkedCell_Model * const LCModel_best = getBestModel(distance); 163 163 164 164 /// Construct new instance if none found, 165 165 if (LCModel_best == NULL) { 166 LinkedCell_Model * LCModel_new = new LinkedCell_Model(distance, domain);166 LinkedCell_Model * const LCModel_new = new LinkedCell_Model(distance, domain); 167 167 LCModel_new->insertPointCloud(set); 168 168 insertNewModel(distance, LCModel_new); 169 LinkedCell_View view( const_cast<const LinkedCell_Model &>(*LCModel_new));169 LinkedCell_View view(*LCModel_new); 170 170 return view; 171 171 } else { -
src/LinkedCell/LinkedCell_Controller.hpp
r54f3d1 r455043 53 53 const LinkedCell_Model * getBestModel(const double distance) const; 54 54 const range<double> getHeuristicRange(const double distance) const; 55 void insertNewModel(const double edgelength, LinkedCell_Model*&instance);55 void insertNewModel(const double edgelength, const LinkedCell_Model* instance); 56 56 57 57 private: 58 58 //!> typedef for the (edge length, model) map 59 typedef std::map<double, LinkedCell_Model* > MapEdgelengthModel;59 typedef std::map<double, const LinkedCell_Model* > MapEdgelengthModel; 60 60 61 61 //!> internal map of present LinkedCell_Model instances by their egde length
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