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 343c5a was 99f4ee, checked in by Frederik Heber <heber@…>, 13 years ago |
|
Class Box is now also an Observable.
- it has two channels to notify about changes in its Matrix and boundary
conditions.
|
-
Property mode
set to
100644
|
|
File size:
1.2 KB
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| Rev | Line | |
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| [77bc4f] | 1 | /*
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| [f844ef] | 2 | * BoxUnitTest.hpp
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| [77bc4f] | 3 | *
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| 4 | * Created on: Jul 30, 2010
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| 5 | * Author: crueger
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| 6 | */
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| 7 |
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| 8 | #ifndef BOXUNITTEST_HPP_
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| 9 | #define BOXUNITTEST_HPP_
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| 10 |
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| [56f73b] | 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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| [77bc4f] | 17 | #include <cppunit/extensions/HelperMacros.h>
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| 18 |
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| [cca9ef] | 19 | class RealSpaceMatrix;
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| [77bc4f] | 20 | class Box;
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| 21 |
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| 22 | class BoxUnittest : public CppUnit::TestFixture
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| 23 | {
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| 24 | CPPUNIT_TEST_SUITE( BoxUnittest );
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| 25 | CPPUNIT_TEST ( setBoxTest );
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| [316d3a] | 26 | CPPUNIT_TEST ( translateInOutTest );
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| [77bc4f] | 27 | CPPUNIT_TEST ( isInsideTest );
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| 28 | CPPUNIT_TEST ( WrapExplodeTest );
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| 29 | CPPUNIT_TEST ( BoundaryBounceTest );
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| 30 | CPPUNIT_TEST ( BoundaryIgnoreTest );
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| 31 | CPPUNIT_TEST ( BoundaryMixedTest );
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| [99f4ee] | 32 | CPPUNIT_TEST ( ObserverTest );
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| [77bc4f] | 33 | CPPUNIT_TEST_SUITE_END();
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| 34 |
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| 35 | public:
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| 36 | void setUp();
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| 37 | void tearDown();
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| 38 |
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| 39 | void setBoxTest();
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| [316d3a] | 40 | void translateInOutTest();
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| [77bc4f] | 41 | void isInsideTest();
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| 42 | void WrapExplodeTest();
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| 43 | void BoundaryBounceTest();
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| 44 | void BoundaryIgnoreTest();
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| 45 | void BoundaryMixedTest();
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| [99f4ee] | 46 | void ObserverTest();
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| [77bc4f] | 47 |
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| [cca9ef] | 48 | RealSpaceMatrix *unit;
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| 49 | RealSpaceMatrix *zero;
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| 50 | RealSpaceMatrix *invertible;
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| 51 | RealSpaceMatrix *uninvertible;
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| [77bc4f] | 52 |
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| 53 | Box *unitBox;
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| 54 | Box *stretchedBox1;
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| 55 | Box *stretchedBox2;
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| 56 | Box *stretchedBox3;
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| 57 | Box *stretchedBox4;
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| 58 | Box *tiltedBox1;
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| 59 | Box *tiltedBox2;
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| 60 | Box *tiltedBox3;
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| 61 | Box *tiltedBox4;
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| 62 | };
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| 63 |
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| 64 | #endif /* BOXUNITTEST_HPP_ */
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