source: src/Filling/unittests/IsValidInDomain_FillPredicateUnitTest.cpp@ baac79

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 baac79 was 600a52, checked in by Frederik Heber <heber@…>, 13 years ago

Added IsInDomain_FillPredicate.

  • added unit test.
  • Property mode set to 100644
File size: 2.9 KB
Line 
1/*
2 * Project: MoleCuilder
3 * Description: creates and alters molecular systems
4 * Copyright (C) 2010-2012 University of Bonn. All rights reserved.
5 * Please see the LICENSE file or "Copyright notice" in builder.cpp for details.
6 */
7
8/*
9 * IsValidInDomain_FillPredicateUnitTest.cpp
10 *
11 * Created on: Jan 18, 2012
12 * Author: heber
13 */
14
15// include config.h
16#ifdef HAVE_CONFIG_H
17#include <config.h>
18#endif
19
20#include <cppunit/CompilerOutputter.h>
21#include <cppunit/extensions/TestFactoryRegistry.h>
22#include <cppunit/ui/text/TestRunner.h>
23
24#include "CodePatterns/Assert.hpp"
25
26#include "Box.hpp"
27#include "Filling/Predicates/IsValidInDomain_FillPredicate.hpp"
28#include "LinearAlgebra/RealSpaceMatrix.hpp"
29#include "Filling/NodeTypes.hpp"
30
31#include "IsValidInDomain_FillPredicateUnitTest.hpp"
32
33#ifdef HAVE_TESTRUNNER
34#include "UnitTestMain.hpp"
35#endif /*HAVE_TESTRUNNER*/
36
37/********************************************** Test classes **************************************/
38
39// Registers the fixture into the 'registry'
40CPPUNIT_TEST_SUITE_REGISTRATION( IsValidInDomain_FillPredicateTest );
41
42
43void IsValidInDomain_FillPredicateTest::setUp()
44{
45 // failing asserts should be thrown
46 ASSERT_DO(Assert::Throw);
47
48 M = new RealSpaceMatrix;
49 M->setIdentity();
50 (*M) *= 20.;
51
52 domain = new Box(*M);
53
54 predicate = new FillPredicate(IsValidInDomain_FillPredicate(*domain));
55}
56
57
58void IsValidInDomain_FillPredicateTest::tearDown()
59{
60 delete predicate;
61 delete domain;
62 delete M;
63}
64
65/** Test whether operator() returns as desired
66 *
67 */
68void IsValidInDomain_FillPredicateTest::operatorTest()
69{
70 Node origin(0.,0.,0.);
71 Node center(10.,10.,10.);
72 Node corner(20.,20.,20.);
73 Node outside(30.,30.,30.);
74
75 for (size_t i=0;i<NDIM;++i)
76 domain->setCondition(i, BoundaryConditions::Wrap);
77
78 // boundary conditions: Wrap
79 {
80 // origin is inside
81 CPPUNIT_ASSERT( (*predicate)(origin) );
82
83 // center is inside
84 CPPUNIT_ASSERT( (*predicate)(center) );
85
86 // corner is inside
87 CPPUNIT_ASSERT( (*predicate)(corner) );
88
89 // outside is outside
90 CPPUNIT_ASSERT( (*predicate)(outside) );
91 }
92
93 // boundary conditions: Bounce
94 {
95 domain->setCondition(0, BoundaryConditions::Bounce);
96 // origin is inside
97 CPPUNIT_ASSERT( (*predicate)(origin) );
98
99 // center is inside
100 CPPUNIT_ASSERT( (*predicate)(center) );
101
102 // corner is inside
103 CPPUNIT_ASSERT( (*predicate)(corner) );
104
105 // outside is outside
106 CPPUNIT_ASSERT( (*predicate)(outside) );
107 domain->setCondition(0, BoundaryConditions::Wrap);
108 }
109
110 // boundary conditions: Ignore
111 {
112 domain->setCondition(0, BoundaryConditions::Ignore);
113 // origin is inside
114 CPPUNIT_ASSERT( (*predicate)(origin) );
115
116 // center is inside
117 CPPUNIT_ASSERT( (*predicate)(center) );
118
119 // corner is inside
120 CPPUNIT_ASSERT( (*predicate)(corner) );
121
122 // outside is outside
123 CPPUNIT_ASSERT( !(*predicate)(outside) );
124 domain->setCondition(0, BoundaryConditions::Wrap);
125 }
126}
Note: See TracBrowser for help on using the repository browser.