| 1 | /* | 
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| 2 | * Project: MoleCuilder | 
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| 3 | * Description: creates and alters molecular systems | 
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| 4 | * Copyright (C)  2010-2012 University of Bonn. All rights reserved. | 
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| 5 | * | 
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| 6 | * | 
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| 7 | *   This file is part of MoleCuilder. | 
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| 8 | * | 
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| 9 | *    MoleCuilder is free software: you can redistribute it and/or modify | 
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| 10 | *    it under the terms of the GNU General Public License as published by | 
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| 11 | *    the Free Software Foundation, either version 2 of the License, or | 
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| 12 | *    (at your option) any later version. | 
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| 13 | * | 
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| 14 | *    MoleCuilder is distributed in the hope that it will be useful, | 
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| 15 | *    but WITHOUT ANY WARRANTY; without even the implied warranty of | 
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| 16 | *    MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE.  See the | 
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| 17 | *    GNU General Public License for more details. | 
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| 18 | * | 
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| 19 | *    You should have received a copy of the GNU General Public License | 
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| 20 | *    along with MoleCuilder.  If not, see <http://www.gnu.org/licenses/>. | 
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| 21 | */ | 
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| 22 |  | 
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| 23 | /* | 
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| 24 | * Ops_FillPredicateUnitTest.cpp | 
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| 25 | * | 
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| 26 | *  Created on: Jan 19, 2012 | 
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| 27 | *      Author: heber | 
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| 28 | */ | 
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| 29 |  | 
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| 30 | // include config.h | 
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| 31 | #ifdef HAVE_CONFIG_H | 
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| 32 | #include <config.h> | 
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| 33 | #endif | 
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| 34 |  | 
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| 35 | #include <cppunit/CompilerOutputter.h> | 
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| 36 | #include <cppunit/extensions/TestFactoryRegistry.h> | 
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| 37 | #include <cppunit/ui/text/TestRunner.h> | 
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| 38 |  | 
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| 39 | #include "CodePatterns/Assert.hpp" | 
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| 40 |  | 
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| 41 | #include "Atom/atom.hpp" | 
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| 42 | #include "Box.hpp" | 
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| 43 | #include "Filling/Predicates/IsValidInDomain_FillPredicate.hpp" | 
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| 44 | #include "Filling/Predicates/IsVoidNode_FillPredicate.hpp" | 
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| 45 | #include "Filling/Predicates/Ops_FillPredicate.hpp" | 
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| 46 | #include "LinearAlgebra/RealSpaceMatrix.hpp" | 
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| 47 | #include "Filling/NodeTypes.hpp" | 
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| 48 | #include "Shapes/BaseShapes.hpp" | 
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| 49 | #include "World.hpp" | 
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| 50 |  | 
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| 51 | #include "Ops_FillPredicateUnitTest.hpp" | 
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| 52 |  | 
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| 53 | #ifdef HAVE_TESTRUNNER | 
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| 54 | #include "UnitTestMain.hpp" | 
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| 55 | #endif /*HAVE_TESTRUNNER*/ | 
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| 56 |  | 
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| 57 | /********************************************** Test classes **************************************/ | 
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| 58 |  | 
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| 59 | // Registers the fixture into the 'registry' | 
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| 60 | CPPUNIT_TEST_SUITE_REGISTRATION( Ops_FillPredicateTest ); | 
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| 61 |  | 
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| 62 | void DoSomething(atom * const _atom) | 
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| 63 | { | 
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| 64 | _atom->setPosition( Vector((double)_atom->getId(), 0., 0.) ); | 
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| 65 | } | 
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| 66 |  | 
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| 67 | void Ops_FillPredicateTest::setUp() | 
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| 68 | { | 
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| 69 | // failing asserts should be thrown | 
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| 70 | ASSERT_DO(Assert::Throw); | 
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| 71 |  | 
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| 72 | // set default BCs to ignore | 
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| 73 | World::getInstance().getDomain().setConditions( | 
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| 74 | BoundaryConditions::Conditions_t(3, BoundaryConditions::Ignore) | 
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| 75 | ); | 
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| 76 |  | 
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| 77 | Domainpredicate = new FillPredicate(IsValidInDomain_FillPredicate(World::getInstance().getDomain())); | 
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| 78 |  | 
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| 79 | // create some atoms as "neighbours" | 
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| 80 | atoms.resize((size_t)5, NULL); | 
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| 81 | std::generate_n(atoms.begin(), (size_t)5, boost::bind(&World::createAtom, World::getPointer()) ); | 
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| 82 |  | 
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| 83 | // position them | 
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| 84 | std::for_each(atoms.begin(), atoms.end(), &DoSomething); | 
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| 85 |  | 
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| 86 | Voidpredicate = new FillPredicate(IsVoidNode_FillPredicate(Sphere())); | 
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| 87 | } | 
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| 88 |  | 
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| 89 |  | 
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| 90 | void Ops_FillPredicateTest::tearDown() | 
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| 91 | { | 
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| 92 | delete Domainpredicate; | 
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| 93 | delete Voidpredicate; | 
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| 94 |  | 
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| 95 | World::purgeInstance(); | 
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| 96 | } | 
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| 97 |  | 
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| 98 | /** Test whether operator() returns as desired | 
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| 99 | * | 
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| 100 | */ | 
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| 101 | void Ops_FillPredicateTest::AndTest() | 
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| 102 | { | 
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| 103 | FillPredicate Andpredicate = (*Domainpredicate) && (*Voidpredicate); | 
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| 104 |  | 
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| 105 | CPPUNIT_ASSERT( !Andpredicate( Vector(-1.,1.,0.)) ); | 
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| 106 | CPPUNIT_ASSERT( !Andpredicate( Vector(-2.,0.,0.)) ); | 
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| 107 | CPPUNIT_ASSERT( Andpredicate( Vector(5.,1.,0.)) ); | 
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| 108 | CPPUNIT_ASSERT( Andpredicate( Vector(5.,0.,1.)) ); | 
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| 109 | for (double i = 0; i < 5.; ++i) { | 
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| 110 | CPPUNIT_ASSERT( !Andpredicate( Vector(i, 0., 0.)) ); | 
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| 111 | CPPUNIT_ASSERT( !Andpredicate( Vector(i, 1., 0.)) ); | 
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| 112 | CPPUNIT_ASSERT( !Andpredicate( Vector(i, -1., 0.)) ); | 
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| 113 | CPPUNIT_ASSERT( !Andpredicate( Vector(i, 0., 1.)) ); | 
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| 114 | CPPUNIT_ASSERT( !Andpredicate( Vector(i, 0., -1.)) ); | 
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| 115 | } | 
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| 116 | CPPUNIT_ASSERT( !Andpredicate( Vector(5.,-1.,0.)) ); | 
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| 117 | CPPUNIT_ASSERT( Andpredicate( Vector(5.,0.,1.)) ); | 
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| 118 | CPPUNIT_ASSERT( !Andpredicate( Vector(5.,0.,-1.)) ); | 
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| 119 | CPPUNIT_ASSERT( Andpredicate( Vector(6.,0.,0.)) ); | 
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| 120 | } | 
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| 121 | /** Test whether operator() returns as desired | 
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| 122 | * | 
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| 123 | */ | 
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| 124 | void Ops_FillPredicateTest::OrTest() | 
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| 125 | { | 
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| 126 | FillPredicate Orpredicate = (*Domainpredicate) || (*Voidpredicate); | 
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| 127 |  | 
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| 128 | // in OR case: Voidpredicate will always throw because it internally checks | 
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| 129 | // whether Linked Cell structure gets correct index to cell, which fails under | 
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| 130 | // Ignore boundary conditions | 
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| 131 | #ifndef NDEBUG | 
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| 132 | std::cout << "The following Assertion is intended and does not represent a failure of the test." << std::endl; | 
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| 133 | CPPUNIT_ASSERT_THROW( Orpredicate( Vector(-1.,1.,0.)), Assert::AssertionFailure ); | 
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| 134 | #else | 
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| 135 | CPPUNIT_ASSERT( Orpredicate( Vector(-1.,1.,0.)) ); | 
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| 136 | #endif | 
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| 137 | CPPUNIT_ASSERT( Orpredicate( Vector(5.,1.,0.)) ); | 
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| 138 | #ifndef NDEBUG | 
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| 139 | std::cout << "The following Assertion is intended and does not represent a failure of the test." << std::endl; | 
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| 140 | CPPUNIT_ASSERT_THROW( Orpredicate( Vector(-2.,0.,0.)), Assert::AssertionFailure ); | 
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| 141 | #else | 
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| 142 | CPPUNIT_ASSERT( Orpredicate( Vector(-2.,0.,0.)) ); | 
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| 143 | #endif | 
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| 144 | for (double i = 0; i < 5.; ++i) { | 
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| 145 | CPPUNIT_ASSERT( Orpredicate( Vector(i, 0., 0.)) ); | 
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| 146 | CPPUNIT_ASSERT( Orpredicate( Vector(i, 1., 0.)) ); | 
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| 147 | #ifndef NDEBUG | 
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| 148 | std::cout << "The following Assertion is intended and does not represent a failure of the test." << std::endl; | 
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| 149 | CPPUNIT_ASSERT_THROW( Orpredicate( Vector(i, -1., 0.)), Assert::AssertionFailure ); | 
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| 150 | #else | 
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| 151 | CPPUNIT_ASSERT( !Orpredicate( Vector(i, -1., 0.)) ); | 
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| 152 | #endif | 
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| 153 | CPPUNIT_ASSERT( Orpredicate( Vector(i, 0., 1.)) ); | 
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| 154 | #ifndef NDEBUG | 
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| 155 | std::cout << "The following Assertion is intended and does not represent a failure of the test." << std::endl; | 
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| 156 | CPPUNIT_ASSERT_THROW( Orpredicate( Vector(i, 0., -1.)), Assert::AssertionFailure ); | 
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| 157 | #else | 
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| 158 | CPPUNIT_ASSERT( !Orpredicate( Vector(i, 0., -1.)) ); | 
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| 159 | #endif | 
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| 160 | } | 
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| 161 | CPPUNIT_ASSERT( Orpredicate( Vector(5.,1.,0.)) ); | 
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| 162 | #ifndef NDEBUG | 
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| 163 | std::cout << "The following Assertion is intended and does not represent a failure of the test." << std::endl; | 
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| 164 | CPPUNIT_ASSERT_THROW( Orpredicate( Vector(5.,-1.,0.)), Assert::AssertionFailure ); | 
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| 165 | #else | 
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| 166 | CPPUNIT_ASSERT( Orpredicate( Vector(5.,-1.,0.)) ); | 
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| 167 | #endif | 
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| 168 | CPPUNIT_ASSERT( Orpredicate( Vector(5.,0.,1.)) ); | 
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| 169 | #ifndef NDEBUG | 
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| 170 | std::cout << "The following Assertion is intended and does not represent a failure of the test." << std::endl; | 
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| 171 | CPPUNIT_ASSERT_THROW( Orpredicate( Vector(5.,0.,-1.)), Assert::AssertionFailure ); | 
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| 172 | #else | 
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| 173 | CPPUNIT_ASSERT( Orpredicate( Vector(5.,0.,-1.)) ); | 
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| 174 | #endif | 
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| 175 | CPPUNIT_ASSERT( Orpredicate( Vector(6.,0.,0.)) ); | 
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| 176 | } | 
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| 177 |  | 
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| 178 | /** Test whether operator!() returns as desired | 
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| 179 | * | 
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| 180 | */ | 
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| 181 | void Ops_FillPredicateTest::NotTest() | 
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| 182 | { | 
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| 183 | Box &domain = World::getInstance().getDomain(); | 
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| 184 | Node origin(0.,0.,0.); | 
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| 185 | Node center(10.,10.,10.); | 
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| 186 | Node corner(20.,20.,20.); | 
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| 187 | Node outside(30.,30.,30.); | 
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| 188 |  | 
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| 189 | FillPredicate Notpredicate = !(*Domainpredicate); | 
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| 190 | FillPredicate Notpredicate2 = !(*Voidpredicate); | 
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| 191 |  | 
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| 192 | domain.setConditions( | 
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| 193 | BoundaryConditions::Conditions_t(3, BoundaryConditions::Wrap) | 
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| 194 | ); | 
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| 195 | // boundary conditions: Wrap | 
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| 196 | { | 
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| 197 | // origin is inside | 
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| 198 | CPPUNIT_ASSERT( !Notpredicate(origin) ); | 
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| 199 |  | 
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| 200 | // center is inside | 
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| 201 | CPPUNIT_ASSERT( !Notpredicate(center) ); | 
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| 202 |  | 
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| 203 | // corner is inside | 
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| 204 | CPPUNIT_ASSERT( !Notpredicate(corner) ); | 
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| 205 |  | 
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| 206 | // outside is outside | 
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| 207 | CPPUNIT_ASSERT( !Notpredicate(outside) ); | 
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| 208 | } | 
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| 209 |  | 
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| 210 | // boundary conditions: Bounce | 
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| 211 | { | 
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| 212 | domain.setCondition(0, BoundaryConditions::Bounce); | 
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| 213 | // origin is inside | 
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| 214 | CPPUNIT_ASSERT( !Notpredicate(origin) ); | 
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| 215 |  | 
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| 216 | // center is inside | 
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| 217 | CPPUNIT_ASSERT( !Notpredicate(center) ); | 
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| 218 |  | 
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| 219 | // corner is inside | 
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| 220 | CPPUNIT_ASSERT( !Notpredicate(corner) ); | 
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| 221 |  | 
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| 222 | // outside is outside | 
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| 223 | CPPUNIT_ASSERT( !Notpredicate(outside) ); | 
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| 224 | domain.setCondition(0, BoundaryConditions::Wrap); | 
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| 225 | } | 
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| 226 |  | 
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| 227 | // boundary conditions: Ignore | 
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| 228 | { | 
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| 229 | domain.setCondition(0, BoundaryConditions::Ignore); | 
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| 230 | // origin is inside | 
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| 231 | CPPUNIT_ASSERT( !Notpredicate(origin) ); | 
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| 232 |  | 
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| 233 | // center is inside | 
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| 234 | CPPUNIT_ASSERT( !Notpredicate(center) ); | 
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| 235 |  | 
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| 236 | // corner is inside | 
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| 237 | CPPUNIT_ASSERT( !Notpredicate(corner) ); | 
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| 238 |  | 
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| 239 | // outside is outside | 
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| 240 | CPPUNIT_ASSERT( Notpredicate(outside) ); | 
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| 241 | domain.setCondition(0, BoundaryConditions::Wrap); | 
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| 242 | } | 
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| 243 |  | 
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| 244 | // set BCs back to default Ignore | 
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| 245 | domain.setConditions( | 
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| 246 | BoundaryConditions::Conditions_t(3, BoundaryConditions::Ignore) | 
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| 247 | ); | 
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| 248 | // check on not void | 
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| 249 | #ifndef NDEBUG | 
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| 250 | std::cout << "The following Assertion is intended and does not represent a failure of the test." << std::endl; | 
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| 251 | CPPUNIT_ASSERT_THROW( Notpredicate2( Vector(-2.,0.,0.)), Assert::AssertionFailure ); | 
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| 252 | #else | 
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| 253 | CPPUNIT_ASSERT( !Notpredicate2( Vector(-2.,0.,0.)) ); | 
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| 254 | #endif | 
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| 255 | for (double i = 0; i < 5.; ++i) { | 
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| 256 | CPPUNIT_ASSERT( Notpredicate2( Vector(i, 0., 0.)) ); | 
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| 257 | CPPUNIT_ASSERT( Notpredicate2( Vector(i, 1., 0.)) ); | 
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| 258 | #ifndef NDEBUG | 
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| 259 | std::cout << "The following Assertion is intended and does not represent a failure of the test." << std::endl; | 
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| 260 | CPPUNIT_ASSERT_THROW( Notpredicate2( Vector(i, -1., 0.)), Assert::AssertionFailure ); | 
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| 261 | #else | 
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| 262 | CPPUNIT_ASSERT( Notpredicate2( Vector(i, -1., 0.)) ); | 
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| 263 | #endif | 
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| 264 | CPPUNIT_ASSERT( Notpredicate2( Vector(i, 0., 1.)) ); | 
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| 265 | #ifndef NDEBUG | 
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| 266 | std::cout << "The following Assertion is intended and does not represent a failure of the test." << std::endl; | 
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| 267 | CPPUNIT_ASSERT_THROW( Notpredicate2( Vector(i, 0., -1.)), Assert::AssertionFailure ); | 
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| 268 | #else | 
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| 269 | CPPUNIT_ASSERT( Notpredicate2( Vector(i, 0., -1.)) ); | 
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| 270 | #endif | 
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| 271 | } | 
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| 272 | CPPUNIT_ASSERT( !Notpredicate2( Vector(5.,1.,0.)) ); | 
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| 273 | #ifndef NDEBUG | 
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| 274 | std::cout << "The following Assertion is intended and does not represent a failure of the test." << std::endl; | 
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| 275 | CPPUNIT_ASSERT_THROW( Notpredicate2( Vector(5.,-1.,0.)), Assert::AssertionFailure ); | 
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| 276 | #else | 
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| 277 | CPPUNIT_ASSERT( !Notpredicate2( Vector(5.,-1.,0.)) ); | 
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| 278 | #endif | 
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| 279 | CPPUNIT_ASSERT( !Notpredicate2( Vector(5.,0.,1.)) ); | 
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| 280 | #ifndef NDEBUG | 
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| 281 | std::cout << "The following Assertion is intended and does not represent a failure of the test." << std::endl; | 
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| 282 | CPPUNIT_ASSERT_THROW( Notpredicate2( Vector(5.,0.,-1.)), Assert::AssertionFailure ); | 
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| 283 | #else | 
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| 284 | CPPUNIT_ASSERT( !Notpredicate2( Vector(5.,0.,-1.)) ); | 
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| 285 | #endif | 
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| 286 | CPPUNIT_ASSERT( !Notpredicate2( Vector(6.,0.,0.)) ); | 
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| 287 | } | 
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