[c4d4df] | 1 | /*
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| 2 | * AnalysisCorrelationToPointUnitTest.cpp
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| 3 | *
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| 4 | * Created on: Oct 13, 2009
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| 5 | * Author: heber
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| 6 | */
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| 7 |
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| 8 | using namespace std;
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| 9 |
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| 10 | #include <cppunit/CompilerOutputter.h>
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| 11 | #include <cppunit/extensions/TestFactoryRegistry.h>
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| 12 | #include <cppunit/ui/text/TestRunner.h>
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| 13 |
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| 14 | #include "analysis_correlation.hpp"
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| 15 | #include "AnalysisCorrelationToPointUnitTest.hpp"
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| 16 |
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| 17 | #include "atom.hpp"
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| 18 | #include "boundary.hpp"
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| 19 | #include "element.hpp"
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| 20 | #include "molecule.hpp"
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| 21 | #include "linkedcell.hpp"
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| 22 | #include "periodentafel.hpp"
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| 23 | #include "tesselation.hpp"
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| 24 |
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| 25 | /********************************************** Test classes **************************************/
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| 26 |
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| 27 | // Registers the fixture into the 'registry'
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| 28 | CPPUNIT_TEST_SUITE_REGISTRATION( AnalysisCorrelationToPointUnitTest );
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| 29 |
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| 30 | void AnalysisCorrelationToPointUnitTest::setUp()
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| 31 | {
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| 32 | atom *Walker = NULL;
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| 33 |
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| 34 | // init private all pointers to zero
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| 35 | TestMolecule = NULL;
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| 36 | hydrogen = NULL;
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| 37 | tafel = NULL;
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| 38 | pointmap = NULL;
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| 39 | binmap = NULL;
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| 40 | point = NULL;
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| 41 |
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| 42 | // construct element
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| 43 | hydrogen = new element;
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| 44 | hydrogen->Z = 1;
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| 45 | strcpy(hydrogen->name, "hydrogen");
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[bbc338] | 46 | strcpy(hydrogen->symbol, "H");
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| 47 |
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[c4d4df] | 48 |
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| 49 | // construct periodentafel
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| 50 | tafel = new periodentafel;
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| 51 | tafel->AddElement(hydrogen);
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| 52 |
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| 53 | // construct molecule (tetraeder of hydrogens)
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| 54 | TestMolecule = new molecule(tafel);
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| 55 | Walker = new atom();
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| 56 | Walker->type = hydrogen;
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| 57 | Walker->node->Init(1., 0., 1. );
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| 58 | TestMolecule->AddAtom(Walker);
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| 59 | Walker = new atom();
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| 60 | Walker->type = hydrogen;
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| 61 | Walker->node->Init(0., 1., 1. );
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| 62 | TestMolecule->AddAtom(Walker);
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| 63 | Walker = new atom();
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| 64 | Walker->type = hydrogen;
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| 65 | Walker->node->Init(1., 1., 0. );
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| 66 | TestMolecule->AddAtom(Walker);
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| 67 | Walker = new atom();
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| 68 | Walker->type = hydrogen;
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| 69 | Walker->node->Init(0., 0., 0. );
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| 70 | TestMolecule->AddAtom(Walker);
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| 71 |
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| 72 | // check that TestMolecule was correctly constructed
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| 73 | CPPUNIT_ASSERT_EQUAL( TestMolecule->AtomCount, 4 );
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| 74 |
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| 75 | // init point
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| 76 | point = new Vector(1.,1.,1.);
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| 77 |
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| 78 | // init maps
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[776b64] | 79 | pointmap = CorrelationToPoint( (ofstream *)&cout, (const molecule * const)TestMolecule, (const element * const)hydrogen, (const Vector *)point );
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[c4d4df] | 80 | binmap = NULL;
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| 81 |
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| 82 | };
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| 83 |
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| 84 |
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| 85 | void AnalysisCorrelationToPointUnitTest::tearDown()
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| 86 | {
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| 87 | if (pointmap != NULL)
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| 88 | delete(pointmap);
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| 89 | if (binmap != NULL)
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| 90 | delete(binmap);
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| 91 |
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| 92 | // remove
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| 93 | delete(TestMolecule);
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| 94 | // note that all the atoms are cleaned by TestMolecule
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| 95 | delete(point);
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| 96 | delete(tafel);
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| 97 | // note that element is cleaned by periodentafel
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| 98 | };
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| 99 |
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| 100 | void AnalysisCorrelationToPointUnitTest::CorrelationToPointTest()
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| 101 | {
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| 102 | // do the pair correlation
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| 103 | CPPUNIT_ASSERT( pointmap != NULL );
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| 104 | CPPUNIT_ASSERT_EQUAL( (size_t)4, pointmap->size() );
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| 105 |
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| 106 | };
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| 107 |
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| 108 | void AnalysisCorrelationToPointUnitTest::CorrelationToPointBinNoRangeTest()
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| 109 | {
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| 110 | BinPairMap::iterator tester;
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| 111 | // put pair correlation into bins and check with no range
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| 112 | binmap = BinData( (ofstream *)&cout, pointmap, 0.5, 0., 0. );
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| 113 | CPPUNIT_ASSERT_EQUAL( (size_t)2, binmap->size() );
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| 114 | //OutputCorrelation ( (ofstream *)&cout, binmap );
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| 115 | tester = binmap->begin();
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| 116 | CPPUNIT_ASSERT_EQUAL( 1., tester->first );
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| 117 | CPPUNIT_ASSERT_EQUAL( 3, tester->second );
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| 118 |
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| 119 | };
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| 120 |
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| 121 | void AnalysisCorrelationToPointUnitTest::CorrelationToPointBinRangeTest()
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| 122 | {
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| 123 | BinPairMap::iterator tester;
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| 124 | // ... and check with [0., 2.] range
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| 125 | binmap = BinData( (ofstream *)&cout, pointmap, 0.5, 0., 2. );
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| 126 | CPPUNIT_ASSERT_EQUAL( (size_t)5, binmap->size() );
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| 127 | //OutputCorrelation ( (ofstream *)&cout, binmap );
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| 128 | tester = binmap->begin();
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| 129 | CPPUNIT_ASSERT_EQUAL( 0., tester->first );
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| 130 | tester = binmap->find(1.);
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| 131 | CPPUNIT_ASSERT_EQUAL( 1., tester->first );
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| 132 | CPPUNIT_ASSERT_EQUAL( 3, tester->second );
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| 133 |
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| 134 | };
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| 135 |
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| 136 | /********************************************** Main routine **************************************/
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| 137 |
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| 138 | int main(int argc, char **argv)
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| 139 | {
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| 140 | // Get the top level suite from the registry
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| 141 | CppUnit::Test *suite = CppUnit::TestFactoryRegistry::getRegistry().makeTest();
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| 142 |
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| 143 | // Adds the test to the list of test to run
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| 144 | CppUnit::TextUi::TestRunner runner;
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| 145 | runner.addTest( suite );
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| 146 |
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| 147 | // Change the default outputter to a compiler error format outputter
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| 148 | runner.setOutputter( new CppUnit::CompilerOutputter( &runner.result(),
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| 149 | std::cerr ) );
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| 150 | // Run the tests.
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| 151 | bool wasSucessful = runner.run();
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| 152 |
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| 153 | // Return error code 1 if the one of test failed.
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| 154 | return wasSucessful ? 0 : 1;
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| 155 | };
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