Changeset 26b4d62 for src/Actions/FillAction
- Timestamp:
- Jun 27, 2014, 9:32:03 PM (11 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:
- c73e35
- Parents:
- 0b6b77
- git-author:
- Frederik Heber <heber@…> (06/19/14 13:56:27)
- git-committer:
- Frederik Heber <heber@…> (06/27/14 21:32:03)
- Location:
- src/Actions/FillAction
- Files:
-
- 2 edited
Legend:
- Unmodified
- Added
- Removed
-
src/Actions/FillAction/FillRegularGridAction.cpp
r0b6b77 r26b4d62 84 84 const std::vector< molecule *> molecules = World::getInstance().getSelectedMolecules(); 85 85 if (molecules.size() != 1) { 86 ELOG(1,"No exactly one molecule selected, aborting,");86 STATUS("No exactly one molecule selected, aborting,"); 87 87 return Action::failure; 88 88 } … … 99 99 if (params.SphereRadius.get() != 0.) { 100 100 if ( atoms.size() == 0) { 101 ELOG(1, "You have given a sphere radius " << params.SphereRadius.get()102 <<" != 0, but have not select any atoms.");101 STATUS("You have given a sphere radius "+toString(params.SphereRadius.get()) 102 +" != 0, but have not select any atoms."); 103 103 return Action::failure; 104 104 } … … 168 168 169 169 if (!successflag) { 170 ELOG(1,"Insertion failed, removing inserted clusters, translating original one back");170 STATUS("Insertion failed, removing inserted clusters, translating original one back"); 171 171 RemoveAtomsFromAtomicInfo(clonedatominfos); 172 172 clonedatoms.clear(); … … 191 191 if (successflag) 192 192 return ActionState::ptr(UndoState); 193 else 193 else { 194 194 return Action::failure; 195 } 195 196 } 196 197 … … 220 221 if (statusflag) 221 222 return ActionState::ptr(_state); 222 else 223 else { 224 STATUS("Failed re-adding filled in atoms."); 223 225 return Action::failure; 226 } 224 227 } 225 228 -
src/Actions/FillAction/FillSurfaceAction.cpp
r0b6b77 r26b4d62 72 72 std::vector<AtomicInfo> movedatoms; 73 73 if (molecules.size() != 1) { 74 ELOG(1,"No exactly one molecule selected, aborting,");74 STATUS("No exactly one molecule selected, aborting,"); 75 75 return Action::failure; 76 76 } … … 112 112 std::vector<Shape*> selectedShapes = ShapeRegistry::getInstance().getSelectedShapes(); 113 113 if (selectedShapes.size() != 1){ 114 ELOG(1, "FillSurfaceAction::performCall(): there has to be exactly 1 selected shape.");114 STATUS("There has to be exactly 1 selected shape."); 115 115 return Action::failure; 116 116 } … … 150 150 151 151 if (!successflag) { 152 ELOG(1,"Insertion failed, removing inserted clusters, translating original one back");152 STATUS("Insertion failed, removing inserted clusters, translating original one back"); 153 153 RemoveAtomsFromAtomicInfo(clonedatominfos); 154 154 clonedatoms.clear(); … … 198 198 if (statusflag) 199 199 return ActionState::ptr(_state); 200 else 200 else { 201 STATUS("Failed to re-added filled in atoms."); 201 202 return Action::failure; 203 } 202 204 } 203 205
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