Changeset 783e88 for src/LinearAlgebra/Plane.cpp
- Timestamp:
- Apr 6, 2011, 1:50:41 PM (14 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:
- 00bb38
- Parents:
- 8b9c43
- git-author:
- Frederik Heber <heber@…> (04/01/11 21:30:33)
- git-committer:
- Frederik Heber <heber@…> (04/06/11 13:50:41)
- File:
-
- 1 edited
Legend:
- Unmodified
- Added
- Removed
-
src/LinearAlgebra/Plane.cpp
r8b9c43 r783e88 27 27 #include "CodePatterns/Log.hpp" 28 28 #include "CodePatterns/Verbose.hpp" 29 #include "Exceptions/MultipleSolutionsException.hpp"30 29 #include "LinearAlgebra/defs.hpp" 31 30 #include "LinearAlgebra/Exceptions.hpp" … … 41 40 normalVector(new Vector()) 42 41 { 43 Vector x1 = y1 -y2; 44 Vector x2 = y3 -y2; 45 if ((fabs(x1.Norm()) <= LINALG_MYEPSILON()) || (fabs(x2.Norm()) <= LINALG_MYEPSILON()) || (fabs(x1.Angle(x2)) <= LINALG_MYEPSILON())) { 46 throw LinearDependenceException(__FILE__,__LINE__); 42 Vector x1 = y1 - y2; 43 Vector x2 = y3 - y2; 44 if ((x1.Norm() <= LINALG_MYEPSILON())) { 45 throw LinearDependenceException() << LinearAlgebraVectorPair( make_pair(&y1, &y2) ); 46 } 47 if ((x2.Norm() <= LINALG_MYEPSILON())) { 48 throw LinearDependenceException() << LinearAlgebraVectorPair( make_pair(&y2, &y3) ); 49 } 50 if((fabs(x1.Angle(x2)) <= LINALG_MYEPSILON())) { 51 throw LinearDependenceException() << LinearAlgebraVectorPair( make_pair(&x1, &x2) ); 47 52 } 48 53 // Log() << Verbose(4) << "relative, first plane coordinates:"; … … 69 74 Vector x1 = y1; 70 75 Vector x2 = y2; 71 if (( fabs(x1.Norm()) <= LINALG_MYEPSILON())) {76 if ((x1.Norm() <= LINALG_MYEPSILON())) { 72 77 throw ZeroVectorException() << LinearAlgebraVector(&x1); 73 78 } 74 if (( fabs(x2.Norm()) <= LINALG_MYEPSILON())) {79 if ((x2.Norm() <= LINALG_MYEPSILON())) { 75 80 throw ZeroVectorException() << LinearAlgebraVector(&x2); 76 81 } 77 82 if((fabs(x1.Angle(x2)) <= LINALG_MYEPSILON())) { 78 throw LinearDependenceException( __FILE__,__LINE__);83 throw LinearDependenceException() << LinearAlgebraVectorPair( make_pair(&x1, &x2) ); 79 84 } 80 85 // Log() << Verbose(4) << "relative, first plane coordinates:"; … … 181 186 Vector res; 182 187 183 double factor1 = getNormal().ScalarProduct(line.getDirection()); 188 res = getNormal(); 189 const Vector direction = line.getDirection(); 190 double factor1 = res.ScalarProduct(direction); 184 191 if(fabs(factor1) <= LINALG_MYEPSILON()){ 185 192 // the plane is parallel... under all circumstances this is bad luck 186 193 // we no have either no or infinite solutions 187 194 if(isContained(line.getOrigin())){ 188 throw MultipleSolutionsException<Vector>(__FILE__,__LINE__,line.getOrigin()); 195 const Vector origin = line.getOrigin(); 196 throw MultipleSolutionsException() << LinearAlgebraVector(&origin); 189 197 } 190 198 else{ 191 throw LinearDependenceException( __FILE__,__LINE__);199 throw LinearDependenceException() << LinearAlgebraVectorPair( make_pair(&res, &direction) ); 192 200 } 193 201 }
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