Action_Thermostats
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        Add_FitFragmentPartialChargesAction
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        Adding_StructOpt_integration_tests
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        Automaking_mpqc_open
        AutomationFragmentation_failures
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        Candidate_v1.6.0
        Candidate_v1.6.1
        Candidate_v1.7.0
        ChangeBugEmailaddress
        ChangingTestPorts
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        Debian_Package_split
        Debian_package_split_molecuildergui_only
        Disabling_MemDebug
        Docu_Python_wait
        EmpiricalPotential_contain_HomologyGraph
        EmpiricalPotential_contain_HomologyGraph_documentation
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        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
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        ForceAnnealing_tocheck
        ForceAnnealing_with_BondGraph
        ForceAnnealing_with_BondGraph_continued
        ForceAnnealing_with_BondGraph_continued_betteresults
        ForceAnnealing_with_BondGraph_contraction-expansion
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        FragmentMolecule_checks_bonddegrees
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        Gui_Fixes
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        IndependentFragmentGrids_IndividualZeroInstances
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        PdbParser_setsAtomName
        PythonUI_with_named_parameters
        QtGui_reactivate_TimeChanged_changes
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        StoppableMakroAction
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        Subpackage_LinearAlgebra
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        TremoloParser_IncreasedPrecision
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        stable
      
      
        
          | Last change
 on this file since 65c323 was             6bd7e0, checked in by Frederik Heber <heber@…>, 14 years ago | 
        
          | 
Renamed old LinkedCell class to LinkedCell_deprecated.
 this is preparatory for a smooth transition to the new implementation.
note that class LinkedCell and namespace LinkedCell bite each other so far.
 | 
        
          | 
              
Property                 mode
 set to                 100644 | 
        
          | File size:
            1.3 KB | 
      
      
| Line |  | 
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| 1 | /* | 
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| 2 | * CandidateForTesselation.hpp | 
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| 3 | * | 
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| 4 | *  Created on: Jul 29, 2010 | 
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| 5 | *      Author: heber | 
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| 6 | */ | 
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| 7 |  | 
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| 8 | #ifndef CANDIDATEFORTESSELATION_HPP_ | 
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| 9 | #define CANDIDATEFORTESSELATION_HPP_ | 
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| 10 |  | 
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| 11 | // include config.h | 
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| 12 | #ifdef HAVE_CONFIG_H | 
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| 13 | #include <config.h> | 
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| 14 | #endif | 
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| 15 |  | 
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| 16 |  | 
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| 17 | #include "BoundaryMaps.hpp" | 
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| 18 | #include "LinearAlgebra/Vector.hpp" | 
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| 19 |  | 
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| 20 | #include <list> | 
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| 21 | #include <set> | 
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| 22 |  | 
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| 23 | class BoundaryLineSet; | 
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| 24 | class BoundaryPointSet; | 
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| 25 | class BoundaryTriangleSet; | 
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| 26 | class LinkedCell_deprecated; | 
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| 27 | class TesselPoint; | 
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| 28 |  | 
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| 29 | class CandidateForTesselation { | 
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| 30 | public : | 
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| 31 | CandidateForTesselation(BoundaryLineSet* currentBaseLine); | 
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| 32 | CandidateForTesselation(TesselPoint* candidate, BoundaryLineSet* currentBaseLine, BoundaryPointSet *point, const Vector &OptCandidateCenter, const Vector &OtherOptCandidateCenter); | 
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| 33 | ~CandidateForTesselation(); | 
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| 34 |  | 
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| 35 | bool CheckValidity(const double RADIUS, const class LinkedCell_deprecated *LC) const; | 
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| 36 |  | 
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| 37 | TesselPointList pointlist; | 
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| 38 | const BoundaryLineSet * BaseLine; | 
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| 39 | const BoundaryPointSet * ThirdPoint; | 
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| 40 | const BoundaryTriangleSet *T; | 
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| 41 | Vector OldCenter; | 
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| 42 | Vector OptCenter; | 
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| 43 | Vector OtherOptCenter; | 
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| 44 | double ShortestAngle; | 
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| 45 | double OtherShortestAngle; | 
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| 46 |  | 
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| 47 | private: | 
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| 48 | static const double HULLEPSILON; //!< TODO: Get rid of HULLEPSILON, points to numerical instabilities | 
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| 49 | }; | 
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| 50 |  | 
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| 51 | std::ostream & operator <<(std::ostream &ost, const  CandidateForTesselation &a); | 
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| 52 |  | 
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| 53 |  | 
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| 54 | #endif /* CANDIDATEFORTESSELATION_HPP_ */ | 
|---|
       
      
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