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) 2012 University of Bonn. All rights reserved.
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5 | * Please see the LICENSE file or "Copyright notice" in builder.cpp for details.
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6 | */
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7 |
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8 | /*
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9 | * LinkedCell_ViewUnitTest.cpp
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10 | *
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11 | * Created on: Nov 18, 2011
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12 | * Author: heber
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13 | */
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14 |
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15 | // include config.h
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16 | #ifdef HAVE_CONFIG_H
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17 | #include <config.h>
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18 | #endif
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19 |
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20 | using namespace std;
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21 |
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22 | #include <cppunit/CompilerOutputter.h>
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23 | #include <cppunit/extensions/TestFactoryRegistry.h>
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24 | #include <cppunit/ui/text/TestRunner.h>
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25 |
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26 | #include <algorithm>
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27 | #include <list>
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28 |
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29 | #include "Box.hpp"
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30 | #include "CodePatterns/Assert.hpp"
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31 | #include "CodePatterns/Log.hpp"
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32 | #include "LinearAlgebra/defs.hpp"
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33 | #include "LinearAlgebra/RealSpaceMatrix.hpp"
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34 | #include "LinkedCell/LinkedCell.hpp"
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35 | #include "LinkedCell/LinkedCell_Model.hpp"
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36 | #include "LinkedCell/LinkedCell_View.hpp"
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37 | #include "LinkedCell/PointCloudAdaptor.hpp"
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38 | #include "LinkedCell/unittests/defs.hpp"
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39 |
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40 | #include "LinkedCell_ViewUnitTest.hpp"
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41 |
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42 | #ifdef HAVE_TESTRUNNER
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43 | #include "UnitTestMain.hpp"
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44 | #endif /*HAVE_TESTRUNNER*/
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45 |
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46 | /********************************************** Test classes **************************************/
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47 |
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48 | // Registers the fixture into the 'registry'
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49 | CPPUNIT_TEST_SUITE_REGISTRATION( LinkedCell_ViewTest );
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50 |
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51 |
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52 | void LinkedCell_ViewTest::setUp()
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53 | {
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54 | // failing asserts should be thrown
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55 | ASSERT_DO(Assert::Throw);
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56 |
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57 | //setVerbosity(3);
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58 |
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59 | // create diag(20.) matrix
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60 | RealSpaceMatrix BoxM;
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61 | BoxM.setIdentity();
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62 | BoxM *= 20.;
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63 |
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64 | // create Box with this matrix
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65 | domain = new Box(BoxM);
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66 |
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67 | // create LinkedCell structure with this Box
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68 | LCImpl = new LinkedCell::LinkedCell_Model(EDGELENGTH, *domain);
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69 |
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70 | // create a list of nodes and add to LCImpl
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71 | std::vector< Vector > VectorList;
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72 | for (size_t i=0;i<((size_t)floor(NUMBERCELLS));++i)
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73 | VectorList.push_back(Vector((double)i*EDGELENGTH,(double)i*EDGELENGTH,(double)i*EDGELENGTH));
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74 | for (size_t i=0;i<VectorList.size();++i) {
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75 | TesselPoint * Walker = new TesselPoint();
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76 | Walker->setName(std::string("Walker")+toString(i));
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77 | Walker->setPosition(VectorList[i]);
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78 | NodeList.insert(Walker);
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79 | LCImpl->addNode(Walker);
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80 | }
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81 |
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82 | // create LinkedCell_View from that
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83 | LC = new LinkedCell::LinkedCell_View(*LCImpl);
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84 | }
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85 |
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86 |
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87 | void LinkedCell_ViewTest::tearDown()
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88 | {
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89 | delete LC;
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90 | delete LCImpl;
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91 | delete domain;
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92 |
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93 | // remove all nodes again
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94 | for (PointSet::iterator iter = NodeList.begin();
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95 | !NodeList.empty();
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96 | iter = NodeList.begin()) {
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97 | delete *iter;
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98 | NodeList.erase(iter);
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99 | }
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100 | }
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101 |
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102 |
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103 | /** UnitTest for getAllNeighbors()
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104 | */
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105 | void LinkedCell_ViewTest::getAllNeighborsTest()
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106 | {
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107 | // define some center vector
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108 | Vector center(DOMAINLENGTH/2.,DOMAINLENGTH/2.,DOMAINLENGTH/2.);
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109 |
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110 | // get LinkedList from LC
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111 | const double distance = 2.;
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112 | LinkedCell::LinkedList NeighborList = LC->getAllNeighbors(distance, center);
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113 | // for (LinkedCell::LinkedList::const_iterator iter = NeighborList.begin();
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114 | // iter != NeighborList.end(); ++iter)
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115 | // std::cout << **iter << " is in returned neighbor list." << std::endl;
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116 |
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117 | // gather points from NodeList
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118 | LinkedCell::LinkedList ComparisonList;
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119 | for (PointSet::const_iterator iter = NodeList.begin(); iter != NodeList.end(); ++iter)
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120 | if (center.DistanceSquared((*iter)->getPosition()) <= distance*distance) {
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121 | ComparisonList.insert(*iter);
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122 | //std::cout << **iter << " is inside of " << center << " plus " << distance << "." << std::endl;
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123 | }
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124 | // check that we get at least as many as needed
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125 | CPPUNIT_ASSERT(ComparisonList.size() <= NeighborList.size());
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126 |
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127 | // check element-wise and skip unrequired ones
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128 | LinkedCell::LinkedList::iterator iter1 = ComparisonList.begin();
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129 | LinkedCell::LinkedList::iterator iter2 = NeighborList.begin();
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130 | for(;(iter1 != ComparisonList.end()) && (iter2 != NeighborList.end()); ++iter1, ++iter2) {
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131 | while (*iter1 != *iter2) {
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132 | CPPUNIT_ASSERT( iter2 != NeighborList.end() );
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133 | ++iter2;
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134 | }
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135 | //std::cout << **iter1 << " == " << **iter2 << std::endl;
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136 | CPPUNIT_ASSERT( iter2 != NeighborList.end() );
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137 | }
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138 | }
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139 |
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140 | /** UnitTest for getPointsInsideSphere()
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141 | */
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142 | void LinkedCell_ViewTest::getPointsInsideSphereTest()
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143 | {
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144 | // define some center vector
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145 | Vector center(DOMAINLENGTH/2.,DOMAINLENGTH/2.,DOMAINLENGTH/2.);
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146 |
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147 | // get LinkedList from LC
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148 | const double distance = 3.;
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149 | LinkedCell::LinkedList NeighborList = LC->getPointsInsideSphere(distance, center);
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150 | // for (LinkedCell::LinkedList::const_iterator iter = NeighborList.begin();
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151 | // iter != NeighborList.end(); ++iter)
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152 | // std::cout << **iter << " is in returned restricted neighbor list." << std::endl;
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153 |
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154 | // gather points from NodeList
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155 | LinkedCell::LinkedList ComparisonList;
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156 | for (PointSet::const_iterator iter = NodeList.begin(); iter != NodeList.end(); ++iter)
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157 | if (center.DistanceSquared((*iter)->getPosition()) <= distance*distance) {
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158 | ComparisonList.insert(*iter);
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159 | //std::cout << **iter << " is inside of " << center << " plus " << distance << "." << std::endl;
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160 | }
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161 | // check that we get at least as many as needed
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162 | CPPUNIT_ASSERT(ComparisonList.size() == NeighborList.size());
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163 |
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164 | // check element-wise and skip unrequired ones
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165 | LinkedCell::LinkedList::iterator iter1 = ComparisonList.begin();
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166 | LinkedCell::LinkedList::iterator iter2 = NeighborList.begin();
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167 | for(;(iter1 != ComparisonList.end()) && (iter2 != NeighborList.end()); ++iter1, ++iter2) {
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168 | //std::cout << **iter1 << " == " << **iter2 << std::endl;
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169 | CPPUNIT_ASSERT( *iter1 == *iter2 );
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170 | }
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171 | }
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172 |
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173 |
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174 | LinkedCell::LinkedCell_View returnView(LinkedCell::LinkedCell_View &view)
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175 | {
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176 | return view;
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177 | }
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178 |
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179 | LinkedCell::LinkedCell_View returnCopiedView(LinkedCell::LinkedCell_View &view)
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180 | {
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181 | LinkedCell::LinkedCell_View retview(view);
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182 | return retview;
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183 | }
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184 |
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185 | /** UnitTest on whether counting in RAIIMap works
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186 | */
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187 | void LinkedCell_ViewTest::RAIIMapTest()
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188 | {
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189 | CPPUNIT_ASSERT_EQUAL( (size_t)1, LinkedCell::LinkedCell_View::RAIIMap.size() );
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190 |
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191 | // check that we are present
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192 | LinkedCell::LinkedCell_View::ModelInstanceMap::iterator iter =
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193 | LinkedCell::LinkedCell_View::RAIIMap.find(LC);
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194 | CPPUNIT_ASSERT( iter != LinkedCell::LinkedCell_View::RAIIMap.end() );
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195 | CPPUNIT_ASSERT( *iter == LC );
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196 |
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197 | // check that we are the only value present
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198 | ++iter;
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199 | CPPUNIT_ASSERT( iter == LinkedCell::LinkedCell_View::RAIIMap.end() );
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200 |
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201 | // add another view and check that there is not assertion
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202 | LinkedCell::LinkedCell_View *view = NULL;
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203 | CPPUNIT_ASSERT_NO_THROW( view = new LinkedCell::LinkedCell_View(*LCImpl) );
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204 | CPPUNIT_ASSERT_EQUAL( (size_t)2, LinkedCell::LinkedCell_View::RAIIMap.size() );
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205 | delete view;
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206 | CPPUNIT_ASSERT_EQUAL( (size_t)1, LinkedCell::LinkedCell_View::RAIIMap.size() );
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207 |
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208 | // copy current view
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209 | {
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210 | LinkedCell::LinkedCell_View view(*LC);
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211 | CPPUNIT_ASSERT_EQUAL( (size_t)2, LinkedCell::LinkedCell_View::RAIIMap.size() );
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212 | LinkedCell::LinkedCell_View view2 = *LC;
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213 | CPPUNIT_ASSERT_EQUAL( (size_t)3, LinkedCell::LinkedCell_View::RAIIMap.size() );
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214 | }
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215 | CPPUNIT_ASSERT_EQUAL( (size_t)1, LinkedCell::LinkedCell_View::RAIIMap.size() );
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216 |
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217 | // with function returning view
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218 | {
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219 | LinkedCell::LinkedCell_View view = returnView(*LC);
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220 | CPPUNIT_ASSERT_EQUAL( (size_t)2, LinkedCell::LinkedCell_View::RAIIMap.size() );
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221 | }
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222 | CPPUNIT_ASSERT_EQUAL( (size_t)1, LinkedCell::LinkedCell_View::RAIIMap.size() );
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223 |
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224 | // with function returning copied view
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225 | {
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226 | LinkedCell::LinkedCell_View view = returnCopiedView(*LC);
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227 | CPPUNIT_ASSERT_EQUAL( (size_t)2, LinkedCell::LinkedCell_View::RAIIMap.size() );
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228 | }
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229 | CPPUNIT_ASSERT_EQUAL( (size_t)1, LinkedCell::LinkedCell_View::RAIIMap.size() );
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230 | }
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231 |
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