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
|
Last change
on this file since 3e1b7b was 5a8d61, checked in by Frederik Heber <heber@…>, 13 years ago |
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Added new function to all Shape: getHomogeneousPointsInVolume().
- basically it is not implemented except for ShapeOps, yet.
- there is an initial unit test Shape_HomogeneousPointsUnitTest.
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-
Property mode
set to
100644
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File size:
1.4 KB
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| 1 | /*
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| 2 | * Shape.hpp
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| 3 | *
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| 4 | * Created on: Jun 18, 2010
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| 5 | * Author: crueger
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| 6 | */
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| 7 |
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| 8 | #ifndef SHAPE_HPP_
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| 9 | #define SHAPE_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 <boost/shared_ptr.hpp>
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| 18 | #include <iosfwd>
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| 19 |
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| 20 | #include "Shapes/ShapeExceptions.hpp"
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| 21 | #include "Shapes/ShapeType.hpp"
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| 22 |
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| 23 | #include <vector>
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| 24 |
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| 25 | class Vector;
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| 26 | class Shape_impl;
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| 27 | class LineSegmentSet;
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| 28 | class Line;
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| 29 |
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| 30 | class Shape
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| 31 | {
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| 32 | public:
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| 33 | typedef boost::shared_ptr<Shape_impl> impl_ptr;
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| 34 | friend impl_ptr getShapeImpl(const Shape&);
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| 35 |
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| 36 | Shape(impl_ptr);
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| 37 | Shape(const Shape&);
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| 38 | virtual ~Shape();
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| 39 |
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| 40 | bool isInside(const Vector &point) const;
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| 41 | bool isOnSurface(const Vector &point) const;
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| 42 | Vector getNormal(const Vector &point) const throw(NotOnSurfaceException);
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| 43 |
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| 44 | Vector getCenter() const;
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| 45 | double getRadius() const;
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| 46 |
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| 47 | LineSegmentSet getLineIntersections(const Line&) const;
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| 48 | std::vector<Vector> getHomogeneousPointsOnSurface(const size_t N) const;
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| 49 | std::vector<Vector> getHomogeneousPointsInVolume(const size_t N) const;
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| 50 |
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| 51 | Shape &operator=(const Shape& rhs);
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| 52 |
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| 53 | bool operator==(const Shape &rhs) const;
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| 54 |
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| 55 | std::string toString() const;
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| 56 | enum ShapeType getType() const;
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| 57 |
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| 58 | protected:
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| 59 | impl_ptr getImpl() const;
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| 60 |
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| 61 | private:
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| 62 | impl_ptr impl;
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| 63 | };
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| 64 |
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| 65 | Shape Everywhere();
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| 66 | Shape Nowhere();
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| 67 |
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| 68 | Shape operator&&(const Shape&,const Shape&);
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| 69 | Shape operator||(const Shape&,const Shape&);
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| 70 | Shape operator!(const Shape&);
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| 71 |
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| 72 | std::ostream &operator<<(std::ostream&,const Shape&);
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| 73 |
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| 74 | #endif /* SHAPE_HPP_ */
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