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src/unittests/MoleculeDescriptorTest.cpp
r57adc7 r23b547 29 29 // set up and tear down 30 30 void MoleculeDescriptorTest::setUp(){ 31 World::get ();31 World::getInstance(); 32 32 for(int i=0;i<MOLECULE_COUNT;++i){ 33 molecules[i]= World::get ()->createMolecule();33 molecules[i]= World::getInstance().createMolecule(); 34 34 moleculeIds[i]= molecules[i]->getId(); 35 35 } … … 37 37 38 38 void MoleculeDescriptorTest::tearDown(){ 39 World:: destroy();39 World::purgeInstance(); 40 40 } 41 41 … … 73 73 74 74 void MoleculeDescriptorTest::MoleculeBaseSetsTest(){ 75 std::vector<molecule*> allMolecules = World::get ()->getAllMolecules(AllMolecules());75 std::vector<molecule*> allMolecules = World::getInstance().getAllMolecules(AllMolecules()); 76 76 CPPUNIT_ASSERT_EQUAL( true , hasAllMolecules(allMolecules,moleculeIds)); 77 77 CPPUNIT_ASSERT_EQUAL( true , hasNoDuplicateMolecules(allMolecules)); 78 78 79 std::vector<molecule*> noMolecules = World::get ()->getAllMolecules(NoMolecules());79 std::vector<molecule*> noMolecules = World::getInstance().getAllMolecules(NoMolecules()); 80 80 CPPUNIT_ASSERT_EQUAL( true , noMolecules.empty()); 81 81 } … … 83 83 // test Molecules from boundaries and middle of the set 84 84 molecule* testMolecule; 85 testMolecule = World::get ()->getMolecule(MoleculeById(moleculeIds[0]));85 testMolecule = World::getInstance().getMolecule(MoleculeById(moleculeIds[0])); 86 86 CPPUNIT_ASSERT(testMolecule); 87 87 CPPUNIT_ASSERT_EQUAL( moleculeIds[0], testMolecule->getId()); 88 testMolecule = World::get ()->getMolecule(MoleculeById(moleculeIds[MOLECULE_COUNT/2]));88 testMolecule = World::getInstance().getMolecule(MoleculeById(moleculeIds[MOLECULE_COUNT/2])); 89 89 CPPUNIT_ASSERT(testMolecule); 90 90 CPPUNIT_ASSERT_EQUAL( moleculeIds[MOLECULE_COUNT/2], testMolecule->getId()); 91 testMolecule = World::get ()->getMolecule(MoleculeById(moleculeIds[MOLECULE_COUNT-1]));91 testMolecule = World::getInstance().getMolecule(MoleculeById(moleculeIds[MOLECULE_COUNT-1])); 92 92 CPPUNIT_ASSERT(testMolecule); 93 93 CPPUNIT_ASSERT_EQUAL( moleculeIds[MOLECULE_COUNT-1], testMolecule->getId()); … … 103 103 } 104 104 // test from outside of set 105 testMolecule = World::get ()->getMolecule(MoleculeById(outsideId));105 testMolecule = World::getInstance().getMolecule(MoleculeById(outsideId)); 106 106 CPPUNIT_ASSERT(!testMolecule); 107 107 } … … 109 109 // test some elementary set operations 110 110 { 111 std::vector<molecule*> testMolecules = World::get ()->getAllMolecules(AllMolecules()||NoMolecules());111 std::vector<molecule*> testMolecules = World::getInstance().getAllMolecules(AllMolecules()||NoMolecules()); 112 112 CPPUNIT_ASSERT_EQUAL( true , hasAllMolecules(testMolecules,moleculeIds)); 113 113 CPPUNIT_ASSERT_EQUAL( true , hasNoDuplicateMolecules(testMolecules)); … … 115 115 116 116 { 117 std::vector<molecule*> testMolecules = World::get ()->getAllMolecules(NoMolecules()||AllMolecules());117 std::vector<molecule*> testMolecules = World::getInstance().getAllMolecules(NoMolecules()||AllMolecules()); 118 118 CPPUNIT_ASSERT_EQUAL( true , hasAllMolecules(testMolecules,moleculeIds)); 119 119 CPPUNIT_ASSERT_EQUAL( true , hasNoDuplicateMolecules(testMolecules)); … … 121 121 122 122 { 123 std::vector<molecule*> testMolecules = World::get ()->getAllMolecules(NoMolecules()&&AllMolecules());123 std::vector<molecule*> testMolecules = World::getInstance().getAllMolecules(NoMolecules()&&AllMolecules()); 124 124 CPPUNIT_ASSERT_EQUAL( true , testMolecules.empty()); 125 125 } 126 126 127 127 { 128 std::vector<molecule*> testMolecules = World::get ()->getAllMolecules(AllMolecules()&&NoMolecules());128 std::vector<molecule*> testMolecules = World::getInstance().getAllMolecules(AllMolecules()&&NoMolecules()); 129 129 CPPUNIT_ASSERT_EQUAL( true , testMolecules.empty()); 130 130 } 131 131 132 132 { 133 std::vector<molecule*> testMolecules = World::get ()->getAllMolecules(!AllMolecules());133 std::vector<molecule*> testMolecules = World::getInstance().getAllMolecules(!AllMolecules()); 134 134 CPPUNIT_ASSERT_EQUAL( true , testMolecules.empty()); 135 135 } 136 136 137 137 { 138 std::vector<molecule*> testMolecules = World::get ()->getAllMolecules(!NoMolecules());138 std::vector<molecule*> testMolecules = World::getInstance().getAllMolecules(!NoMolecules()); 139 139 CPPUNIT_ASSERT_EQUAL( true , hasAllMolecules(testMolecules,moleculeIds)); 140 140 CPPUNIT_ASSERT_EQUAL( true , hasNoDuplicateMolecules(testMolecules)); … … 143 143 // exclude and include some molecules 144 144 { 145 std::vector<molecule*> testMolecules = World::get ()->getAllMolecules(AllMolecules()&&(!MoleculeById(moleculeIds[MOLECULE_COUNT/2])));145 std::vector<molecule*> testMolecules = World::getInstance().getAllMolecules(AllMolecules()&&(!MoleculeById(moleculeIds[MOLECULE_COUNT/2]))); 146 146 std::set<moleculeId_t> excluded; 147 147 excluded.insert(moleculeIds[MOLECULE_COUNT/2]); … … 152 152 153 153 { 154 std::vector<molecule*> testMolecules = World::get ()->getAllMolecules(NoMolecules()||(MoleculeById(moleculeIds[MOLECULE_COUNT/2])));154 std::vector<molecule*> testMolecules = World::getInstance().getAllMolecules(NoMolecules()||(MoleculeById(moleculeIds[MOLECULE_COUNT/2]))); 155 155 CPPUNIT_ASSERT_EQUAL( (size_t)1, testMolecules.size()); 156 156 CPPUNIT_ASSERT_EQUAL( moleculeIds[MOLECULE_COUNT/2], testMolecules[0]->getId());
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