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
      
      
        
          | Last change
 on this file since 92d756 was             88b400, checked in by Frederik Heber <heber@…>, 15 years ago | 
        
          | 
converted #define's to enums, consts and typedefs [Meyers, "Effective C++", item 1].
 
basic changes:
 #define bla 1.3 -> const double bla = 1.3
#define bla "test" -> const char * const bla = "test
use class specific constants! (HULLEPSILON)
 
const int Class::bla = 1.3; (in .cpp)static const int bla; (in .hpp inside class private section)
 
 "enum hack": #define bla 5 -> enum { bla = 5 };
if const int bla=5; impossible
e.g. necessary if constant is used in array declaration (int blabla[bla];)
 
details:
 new file defs.cpp where const double reside in and are referenced by extern "C" const double
joiner.cpp: main() had to be changed due to concatenation of two #define possible, of two const char * not
class specific constants: HULLEPSILON, BONDTHRESHOLD, SPHERERADIUS
extended GetPathLengthonCircumCircle to additional parameter HULLEPSILON
 | 
        
          | 
              
Property                 mode
 set to                 100644 | 
        
          | File size:
            1.7 KB | 
      
      
| Line |  | 
|---|
| 1 | /* | 
|---|
| 2 | * BoundaryTriangleSet.hpp | 
|---|
| 3 | * | 
|---|
| 4 | *  Created on: Jul 29, 2010 | 
|---|
| 5 | *      Author: heber | 
|---|
| 6 | */ | 
|---|
| 7 |  | 
|---|
| 8 | #ifndef BOUNDARYTRIANGLESET_HPP_ | 
|---|
| 9 | #define BOUNDARYTRIANGLESET_HPP_ | 
|---|
| 10 |  | 
|---|
| 11 | #include "BoundaryMaps.hpp" | 
|---|
| 12 | #include "LinearAlgebra/Vector.hpp" | 
|---|
| 13 |  | 
|---|
| 14 | class BoundaryLineSet; | 
|---|
| 15 | class BoundaryPointSet; | 
|---|
| 16 | class BoundaryTriangleSet; | 
|---|
| 17 | class Plane; | 
|---|
| 18 | class TesselPoint; | 
|---|
| 19 |  | 
|---|
| 20 | class BoundaryTriangleSet { | 
|---|
| 21 | public: | 
|---|
| 22 | BoundaryTriangleSet(); | 
|---|
| 23 | BoundaryTriangleSet(class BoundaryLineSet * const line[3], const int number); | 
|---|
| 24 | ~BoundaryTriangleSet(); | 
|---|
| 25 |  | 
|---|
| 26 | void GetNormalVector(const Vector &NormalVector); | 
|---|
| 27 | void GetCenter(Vector ¢er) const; | 
|---|
| 28 | bool GetIntersectionInsideTriangle(const Vector & MolCenter, const Vector &x, Vector &Intersection) const; | 
|---|
| 29 | double GetClosestPointInsideTriangle(const Vector &x, Vector &ClosestPoint) const; | 
|---|
| 30 | bool ContainsBoundaryLine(const BoundaryLineSet * const line) const; | 
|---|
| 31 | bool ContainsBoundaryPoint(const BoundaryPointSet * const point) const; | 
|---|
| 32 | bool ContainsBoundaryPoint(const TesselPoint * const point) const; | 
|---|
| 33 | class BoundaryPointSet *GetThirdEndpoint(const BoundaryLineSet * const line) const; | 
|---|
| 34 | class BoundaryLineSet *GetThirdLine(const BoundaryPointSet * const point) const; | 
|---|
| 35 | bool IsPresentTupel(const BoundaryPointSet * const Points[3]) const; | 
|---|
| 36 | bool IsPresentTupel(const BoundaryTriangleSet * const T) const; | 
|---|
| 37 |  | 
|---|
| 38 | Plane getPlane() const; | 
|---|
| 39 | Vector getEndpoint(int) const; | 
|---|
| 40 | std::string getEndpointName(int) const; | 
|---|
| 41 |  | 
|---|
| 42 | class BoundaryPointSet *endpoints[3]; | 
|---|
| 43 | class BoundaryLineSet *lines[3]; | 
|---|
| 44 | Vector NormalVector; | 
|---|
| 45 | Vector SphereCenter; | 
|---|
| 46 | int Nr; | 
|---|
| 47 |  | 
|---|
| 48 | private: | 
|---|
| 49 |  | 
|---|
| 50 | }; | 
|---|
| 51 |  | 
|---|
| 52 | std::ostream & operator << (std::ostream &ost, const BoundaryTriangleSet &a); | 
|---|
| 53 |  | 
|---|
| 54 |  | 
|---|
| 55 | #endif /* BOUNDARYTRIANGLESET_HPP_ */ | 
|---|
       
      
  Note:
 See   
TracBrowser
 for help on using the repository browser.