Changeset a7c344 for src/Plane.cpp

Timestamp:

Jun 19, 2010, 4:06:59 PM (15 years ago)

Author:

Frederik Heber <heber@…>

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, Candidate_v1.7.0, 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:

c39cc4

Parents:

b32dbb (diff), 27ac00 (diff)
Note: this is a merge changeset, the changes displayed below correspond to the merge itself.
Use the (diff) links above to see all the changes relative to each parent.

Message:

Merge branch 'StructureRefactoring' of jupiter:espack into StructureRefactoring

File:

• src/Plane.cpp (modified) (4 diffs)

src/Plane.cpp

@@ -14 +14 @@
 #include "Helpers/Assert.hpp"
 #include <cmath>
+#include "Line.hpp"
+#include "Exceptions/MultipleSolutionsException.hpp"
 
 /**
@@ -42 +44 @@
 /**
  * Constructs a plane from two direction vectors and a offset.
- * If no offset is given a plane through origin is assumed
  */
 Plane::Plane(const Vector &y1, const Vector &y2, double _offset) throw(ZeroVectorException,LinearDependenceException) :
@@ -113 +114 @@
 }
 
-Vector Plane::getOffsetVector() {
+Vector Plane::getOffsetVector() const {
   return getOffset()*getNormal();
 }
 
-vector<Vector> Plane::getPointsOnPlane(){
+vector<Vector> Plane::getPointsOnPlane() const{
   std::vector<Vector> res;
   res.reserve(3);
@@ -147 +148 @@
  * \return true -  \a this contains intersection point on return, false - line is parallel to plane (even if in-plane)
  */
-Vector Plane::GetIntersection(const Vector &Origin, const Vector &LineVector)
+Vector Plane::GetIntersection(const Line& line) const
 {
   Info FunctionInfo(__func__);
   Vector res;
 
-  // find intersection of a line defined by Offset and Direction with a  plane defined by triangle
-  Vector Direction = LineVector - Origin;
-  Direction.Normalize();
-  Log() << Verbose(1) << "INFO: Direction is " << Direction << "." << endl;
-  //Log() << Verbose(1) << "INFO: PlaneNormal is " << *PlaneNormal << " and PlaneOffset is " << *PlaneOffset << "." << endl;
-  double factor1 = Direction.ScalarProduct(*normalVector.get());
-  if (fabs(factor1) < MYEPSILON) { // Uniqueness: line parallel to plane?
-    Log() << Verbose(1) << "BAD: Line is parallel to plane, no intersection." << endl;
-    throw LinearDependenceException(__FILE__,__LINE__);
-  }
-
-  double factor2 = Origin.ScalarProduct(*normalVector.get());
-  if (fabs(factor2-offset) < MYEPSILON) { // Origin is in-plane
-    Log() << Verbose(1) << "GOOD: Origin of line is in-plane." << endl;
-    res = Origin;
-    return res;
-  }
-
+  double factor1 = getNormal().ScalarProduct(line.getDirection());
+  if(fabs(factor1)<MYEPSILON){
+    // the plane is parallel... under all circumstances this is bad luck
+    // we no have either no or infinite solutions
+    if(isContained(line.getOrigin())){
+      throw MultipleSolutionsException<Vector>(__FILE__,__LINE__,line.getOrigin());
+    }
+    else{
+      throw LinearDependenceException(__FILE__,__LINE__);
+    }
+  }
+
+  double factor2 = getNormal().ScalarProduct(line.getOrigin());
   double scaleFactor = (offset-factor2)/factor1;
 
-  //factor = Origin->ScalarProduct(PlaneNormal)*(-PlaneOffset->ScalarProduct(PlaneNormal))/(Direction.ScalarProduct(PlaneNormal));
-  Direction.Scale(scaleFactor);
-  res = Origin + Direction;
-  Log() << Verbose(1) << "INFO: Scaled direction is " << Direction << "." << endl;
-
-  // test whether resulting vector really is on plane
-  ASSERT(fabs(res.ScalarProduct(*normalVector) - offset) < MYEPSILON,
-         "Calculated line-Plane intersection does not lie on plane.");
+  res = line.getOrigin() + scaleFactor * line.getDirection();
+
+  // tests to make sure the resulting vector really is on plane and line
+  ASSERT(isContained(res),"Calculated line-Plane intersection does not lie on plane.");
+  ASSERT(line.isContained(res),"Calculated line-Plane intersection does not lie on line.");
   return res;
 };
+
+Vector Plane::mirrorVector(const Vector &rhs) const {
+  Vector helper = getVectorToPoint(rhs);
+  // substract twice the Vector to the plane
+  return rhs+2*helper;
+}
+
+Line Plane::getOrthogonalLine(const Vector &origin) const{
+  return Line(origin,getNormal());
+}
 
 /************ Methods inherited from Space ****************/