| 1 | /* | 
|---|
| 2 | * Project: MoleCuilder | 
|---|
| 3 | * Description: creates and alters molecular systems | 
|---|
| 4 | * Copyright (C)  2014 Frederik Heber. All rights reserved. | 
|---|
| 5 | * | 
|---|
| 6 | * | 
|---|
| 7 | *   This file is part of MoleCuilder. | 
|---|
| 8 | * | 
|---|
| 9 | *    MoleCuilder is free software: you can redistribute it and/or modify | 
|---|
| 10 | *    it under the terms of the GNU General Public License as published by | 
|---|
| 11 | *    the Free Software Foundation, either version 2 of the License, or | 
|---|
| 12 | *    (at your option) any later version. | 
|---|
| 13 | * | 
|---|
| 14 | *    MoleCuilder is distributed in the hope that it will be useful, | 
|---|
| 15 | *    but WITHOUT ANY WARRANTY; without even the implied warranty of | 
|---|
| 16 | *    MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE.  See the | 
|---|
| 17 | *    GNU General Public License for more details. | 
|---|
| 18 | * | 
|---|
| 19 | *    You should have received a copy of the GNU General Public License | 
|---|
| 20 | *    along with MoleCuilder.  If not, see <http://www.gnu.org/licenses/>. | 
|---|
| 21 | */ | 
|---|
| 22 |  | 
|---|
| 23 | /* | 
|---|
| 24 | * SphericalPointDistributionUnitTest.cpp | 
|---|
| 25 | * | 
|---|
| 26 | *  Created on: May 29, 2014 | 
|---|
| 27 | *      Author: heber | 
|---|
| 28 | */ | 
|---|
| 29 |  | 
|---|
| 30 | // include config.h | 
|---|
| 31 | #ifdef HAVE_CONFIG_H | 
|---|
| 32 | #include <config.h> | 
|---|
| 33 | #endif | 
|---|
| 34 |  | 
|---|
| 35 | using namespace std; | 
|---|
| 36 |  | 
|---|
| 37 | #include <cppunit/CompilerOutputter.h> | 
|---|
| 38 | #include <cppunit/extensions/TestFactoryRegistry.h> | 
|---|
| 39 | #include <cppunit/ui/text/TestRunner.h> | 
|---|
| 40 |  | 
|---|
| 41 | // include headers that implement a archive in simple text format | 
|---|
| 42 | #include <boost/archive/text_oarchive.hpp> | 
|---|
| 43 | #include <boost/archive/text_iarchive.hpp> | 
|---|
| 44 |  | 
|---|
| 45 | #include "SphericalPointDistributionUnitTest.hpp" | 
|---|
| 46 |  | 
|---|
| 47 | #include <boost/assign.hpp> | 
|---|
| 48 |  | 
|---|
| 49 | #include "CodePatterns/Assert.hpp" | 
|---|
| 50 | #include "CodePatterns/Log.hpp" | 
|---|
| 51 |  | 
|---|
| 52 | #include "Fragmentation/Exporters/SphericalPointDistribution.hpp" | 
|---|
| 53 |  | 
|---|
| 54 | #ifdef HAVE_TESTRUNNER | 
|---|
| 55 | #include "UnitTestMain.hpp" | 
|---|
| 56 | #endif /*HAVE_TESTRUNNER*/ | 
|---|
| 57 |  | 
|---|
| 58 | using namespace boost::assign; | 
|---|
| 59 |  | 
|---|
| 60 | /********************************************** Test classes **************************************/ | 
|---|
| 61 |  | 
|---|
| 62 | // Registers the fixture into the 'registry' | 
|---|
| 63 | CPPUNIT_TEST_SUITE_REGISTRATION( SphericalPointDistributionTest ); | 
|---|
| 64 |  | 
|---|
| 65 |  | 
|---|
| 66 | void SphericalPointDistributionTest::setUp() | 
|---|
| 67 | { | 
|---|
| 68 | // failing asserts should be thrown | 
|---|
| 69 | ASSERT_DO(Assert::Throw); | 
|---|
| 70 |  | 
|---|
| 71 | setVerbosity(5); | 
|---|
| 72 | } | 
|---|
| 73 |  | 
|---|
| 74 |  | 
|---|
| 75 | void SphericalPointDistributionTest::tearDown() | 
|---|
| 76 | { | 
|---|
| 77 | } | 
|---|
| 78 |  | 
|---|
| 79 | /** UnitTest for matchSphericalPointDistributions() with two points | 
|---|
| 80 | */ | 
|---|
| 81 | void SphericalPointDistributionTest::matchSphericalPointDistributionsTest_2() | 
|---|
| 82 | { | 
|---|
| 83 | SphericalPointDistribution SPD(1.); | 
|---|
| 84 | // test with one point, matching trivially | 
|---|
| 85 | { | 
|---|
| 86 | SphericalPointDistribution::Polygon_t polygon; | 
|---|
| 87 | polygon += Vector(1.,0.,0.); | 
|---|
| 88 | SphericalPointDistribution::Polygon_t newpolygon = | 
|---|
| 89 | SPD.get<2>(); | 
|---|
| 90 | SphericalPointDistribution::Polygon_t expected; | 
|---|
| 91 | expected += Vector(-1.,0.,0.); | 
|---|
| 92 | SphericalPointDistribution::Polygon_t remaining = | 
|---|
| 93 | SphericalPointDistribution::matchSphericalPointDistributions( | 
|---|
| 94 | polygon, | 
|---|
| 95 | newpolygon); | 
|---|
| 96 | CPPUNIT_ASSERT_EQUAL( expected, remaining ); | 
|---|
| 97 | } | 
|---|
| 98 |  | 
|---|
| 99 | // test with one point, just a flip of axis | 
|---|
| 100 | { | 
|---|
| 101 | SphericalPointDistribution::Polygon_t polygon; | 
|---|
| 102 | polygon += Vector(0.,1.,0.); | 
|---|
| 103 | SphericalPointDistribution::Polygon_t newpolygon = | 
|---|
| 104 | SPD.get<2>(); | 
|---|
| 105 | SphericalPointDistribution::Polygon_t expected; | 
|---|
| 106 | expected += Vector(0.,-1.,0.); | 
|---|
| 107 | SphericalPointDistribution::Polygon_t remaining = | 
|---|
| 108 | SphericalPointDistribution::matchSphericalPointDistributions( | 
|---|
| 109 | polygon, | 
|---|
| 110 | newpolygon); | 
|---|
| 111 | CPPUNIT_ASSERT_EQUAL( expected, remaining ); | 
|---|
| 112 | } | 
|---|
| 113 |  | 
|---|
| 114 | // test with one point, just a flip to another axis | 
|---|
| 115 | { | 
|---|
| 116 | SphericalPointDistribution::Polygon_t polygon; | 
|---|
| 117 | polygon += Vector(0.,0.,-1.); | 
|---|
| 118 | SphericalPointDistribution::Polygon_t newpolygon = | 
|---|
| 119 | SPD.get<2>(); | 
|---|
| 120 | SphericalPointDistribution::Polygon_t expected; | 
|---|
| 121 | expected += Vector(0.,0.,1.); | 
|---|
| 122 | SphericalPointDistribution::Polygon_t remaining = | 
|---|
| 123 | SphericalPointDistribution::matchSphericalPointDistributions( | 
|---|
| 124 | polygon, | 
|---|
| 125 | newpolygon); | 
|---|
| 126 | CPPUNIT_ASSERT_EQUAL( expected, remaining ); | 
|---|
| 127 | } | 
|---|
| 128 | } | 
|---|
| 129 |  | 
|---|
| 130 | /** UnitTest for matchSphericalPointDistributions() with three points | 
|---|
| 131 | */ | 
|---|
| 132 | void SphericalPointDistributionTest::matchSphericalPointDistributionsTest_3() | 
|---|
| 133 | { | 
|---|
| 134 | SphericalPointDistribution SPD(1.); | 
|---|
| 135 |  | 
|---|
| 136 | // test with one point, matching trivially | 
|---|
| 137 | { | 
|---|
| 138 | SphericalPointDistribution::Polygon_t polygon; | 
|---|
| 139 | polygon += Vector(1.,0.,0.); | 
|---|
| 140 | SphericalPointDistribution::Polygon_t newpolygon = | 
|---|
| 141 | SPD.get<3>(); | 
|---|
| 142 | SphericalPointDistribution::Polygon_t expected = newpolygon; | 
|---|
| 143 | expected.pop_front(); // remove first point | 
|---|
| 144 | SphericalPointDistribution::Polygon_t remaining = | 
|---|
| 145 | SphericalPointDistribution::matchSphericalPointDistributions( | 
|---|
| 146 | polygon, | 
|---|
| 147 | newpolygon); | 
|---|
| 148 | CPPUNIT_ASSERT_EQUAL( expected, remaining ); | 
|---|
| 149 | } | 
|---|
| 150 |  | 
|---|
| 151 | // test with one point, just a flip of axis | 
|---|
| 152 | { | 
|---|
| 153 | SphericalPointDistribution::Polygon_t polygon; | 
|---|
| 154 | polygon += Vector(0.,1.,0.); | 
|---|
| 155 | SphericalPointDistribution::Polygon_t newpolygon = | 
|---|
| 156 | SPD.get<3>(); | 
|---|
| 157 | SphericalPointDistribution::Polygon_t expected = newpolygon; | 
|---|
| 158 | expected.pop_front(); // remove first point | 
|---|
| 159 | SphericalPointDistribution::Polygon_t remaining = | 
|---|
| 160 | SphericalPointDistribution::matchSphericalPointDistributions( | 
|---|
| 161 | polygon, | 
|---|
| 162 | newpolygon); | 
|---|
| 163 | CPPUNIT_ASSERT_EQUAL( expected, remaining ); | 
|---|
| 164 | } | 
|---|
| 165 | } | 
|---|
| 166 |  | 
|---|
| 167 | /** UnitTest for matchSphericalPointDistributions() with four points | 
|---|
| 168 | */ | 
|---|
| 169 | void SphericalPointDistributionTest::matchSphericalPointDistributionsTest_4() | 
|---|
| 170 | { | 
|---|
| 171 | SphericalPointDistribution SPD(1.); | 
|---|
| 172 |  | 
|---|
| 173 | // test with one point, matching trivially | 
|---|
| 174 | { | 
|---|
| 175 | SphericalPointDistribution::Polygon_t polygon; | 
|---|
| 176 | polygon += Vector(1.,0.,0.); | 
|---|
| 177 | SphericalPointDistribution::Polygon_t newpolygon = | 
|---|
| 178 | SPD.get<4>(); | 
|---|
| 179 | SphericalPointDistribution::Polygon_t expected = newpolygon; | 
|---|
| 180 | expected.pop_front(); // remove first point | 
|---|
| 181 | SphericalPointDistribution::Polygon_t remaining = | 
|---|
| 182 | SphericalPointDistribution::matchSphericalPointDistributions( | 
|---|
| 183 | polygon, | 
|---|
| 184 | newpolygon); | 
|---|
| 185 | CPPUNIT_ASSERT_EQUAL( expected, remaining ); | 
|---|
| 186 | } | 
|---|
| 187 |  | 
|---|
| 188 | // test with one point, just a flip of axis | 
|---|
| 189 | { | 
|---|
| 190 | SphericalPointDistribution::Polygon_t polygon; | 
|---|
| 191 | polygon += Vector(0.,1.,0.); | 
|---|
| 192 | SphericalPointDistribution::Polygon_t newpolygon = | 
|---|
| 193 | SPD.get<4>(); | 
|---|
| 194 | SphericalPointDistribution::Polygon_t expected = newpolygon; | 
|---|
| 195 | expected.pop_front(); // remove first point | 
|---|
| 196 | SphericalPointDistribution::Polygon_t remaining = | 
|---|
| 197 | SphericalPointDistribution::matchSphericalPointDistributions( | 
|---|
| 198 | polygon, | 
|---|
| 199 | newpolygon); | 
|---|
| 200 | CPPUNIT_ASSERT_EQUAL( expected, remaining ); | 
|---|
| 201 | } | 
|---|
| 202 | } | 
|---|
| 203 |  | 
|---|
| 204 | /** UnitTest for matchSphericalPointDistributions() with five points | 
|---|
| 205 | */ | 
|---|
| 206 | void SphericalPointDistributionTest::matchSphericalPointDistributionsTest_5() | 
|---|
| 207 | { | 
|---|
| 208 | SphericalPointDistribution SPD(1.); | 
|---|
| 209 |  | 
|---|
| 210 | // test with one point, matching trivially | 
|---|
| 211 | { | 
|---|
| 212 | SphericalPointDistribution::Polygon_t polygon; | 
|---|
| 213 | polygon += Vector(1.,0.,0.); | 
|---|
| 214 | SphericalPointDistribution::Polygon_t newpolygon = | 
|---|
| 215 | SPD.get<5>(); | 
|---|
| 216 | SphericalPointDistribution::Polygon_t expected = newpolygon; | 
|---|
| 217 | expected.pop_front(); // remove first point | 
|---|
| 218 | SphericalPointDistribution::Polygon_t remaining = | 
|---|
| 219 | SphericalPointDistribution::matchSphericalPointDistributions( | 
|---|
| 220 | polygon, | 
|---|
| 221 | newpolygon); | 
|---|
| 222 | CPPUNIT_ASSERT_EQUAL( expected, remaining ); | 
|---|
| 223 | } | 
|---|
| 224 |  | 
|---|
| 225 | // test with one point, just a flip of axis | 
|---|
| 226 | { | 
|---|
| 227 | SphericalPointDistribution::Polygon_t polygon; | 
|---|
| 228 | polygon += Vector(0.,1.,0.); | 
|---|
| 229 | SphericalPointDistribution::Polygon_t newpolygon = | 
|---|
| 230 | SPD.get<5>(); | 
|---|
| 231 | SphericalPointDistribution::Polygon_t expected = newpolygon; | 
|---|
| 232 | expected.pop_front(); // remove first point | 
|---|
| 233 | SphericalPointDistribution::Polygon_t remaining = | 
|---|
| 234 | SphericalPointDistribution::matchSphericalPointDistributions( | 
|---|
| 235 | polygon, | 
|---|
| 236 | newpolygon); | 
|---|
| 237 | CPPUNIT_ASSERT_EQUAL( expected, remaining ); | 
|---|
| 238 | } | 
|---|
| 239 | } | 
|---|
| 240 |  | 
|---|
| 241 | /** UnitTest for matchSphericalPointDistributions() with six points | 
|---|
| 242 | */ | 
|---|
| 243 | void SphericalPointDistributionTest::matchSphericalPointDistributionsTest_6() | 
|---|
| 244 | { | 
|---|
| 245 | SphericalPointDistribution SPD(1.); | 
|---|
| 246 |  | 
|---|
| 247 | // test with one point, matching trivially | 
|---|
| 248 | { | 
|---|
| 249 | SphericalPointDistribution::Polygon_t polygon; | 
|---|
| 250 | polygon += Vector(1.,0.,0.); | 
|---|
| 251 | SphericalPointDistribution::Polygon_t newpolygon = | 
|---|
| 252 | SPD.get<6>(); | 
|---|
| 253 | SphericalPointDistribution::Polygon_t expected = newpolygon; | 
|---|
| 254 | expected.pop_front(); // remove first point | 
|---|
| 255 | SphericalPointDistribution::Polygon_t remaining = | 
|---|
| 256 | SphericalPointDistribution::matchSphericalPointDistributions( | 
|---|
| 257 | polygon, | 
|---|
| 258 | newpolygon); | 
|---|
| 259 | CPPUNIT_ASSERT_EQUAL( expected, remaining ); | 
|---|
| 260 | } | 
|---|
| 261 |  | 
|---|
| 262 | // test with one point, just a flip of axis | 
|---|
| 263 | { | 
|---|
| 264 | SphericalPointDistribution::Polygon_t polygon; | 
|---|
| 265 | polygon += Vector(0.,1.,0.); | 
|---|
| 266 | SphericalPointDistribution::Polygon_t newpolygon = | 
|---|
| 267 | SPD.get<6>(); | 
|---|
| 268 | SphericalPointDistribution::Polygon_t expected = newpolygon; | 
|---|
| 269 | expected.pop_front(); // remove first point | 
|---|
| 270 | SphericalPointDistribution::Polygon_t remaining = | 
|---|
| 271 | SphericalPointDistribution::matchSphericalPointDistributions( | 
|---|
| 272 | polygon, | 
|---|
| 273 | newpolygon); | 
|---|
| 274 | CPPUNIT_ASSERT_EQUAL( expected, remaining ); | 
|---|
| 275 | } | 
|---|
| 276 | } | 
|---|
| 277 |  | 
|---|
| 278 | /** UnitTest for matchSphericalPointDistributions() with seven points | 
|---|
| 279 | */ | 
|---|
| 280 | void SphericalPointDistributionTest::matchSphericalPointDistributionsTest_7() | 
|---|
| 281 | { | 
|---|
| 282 | SphericalPointDistribution SPD(1.); | 
|---|
| 283 |  | 
|---|
| 284 | // test with one point, matching trivially | 
|---|
| 285 | { | 
|---|
| 286 | SphericalPointDistribution::Polygon_t polygon; | 
|---|
| 287 | polygon += Vector(1.,0.,0.); | 
|---|
| 288 | SphericalPointDistribution::Polygon_t newpolygon = | 
|---|
| 289 | SPD.get<7>(); | 
|---|
| 290 | SphericalPointDistribution::Polygon_t expected = newpolygon; | 
|---|
| 291 | expected.pop_front(); // remove first point | 
|---|
| 292 | SphericalPointDistribution::Polygon_t remaining = | 
|---|
| 293 | SphericalPointDistribution::matchSphericalPointDistributions( | 
|---|
| 294 | polygon, | 
|---|
| 295 | newpolygon); | 
|---|
| 296 | CPPUNIT_ASSERT_EQUAL( expected, remaining ); | 
|---|
| 297 | } | 
|---|
| 298 |  | 
|---|
| 299 | // test with one point, just a flip of axis | 
|---|
| 300 | { | 
|---|
| 301 | SphericalPointDistribution::Polygon_t polygon; | 
|---|
| 302 | polygon += Vector(0.,1.,0.); | 
|---|
| 303 | SphericalPointDistribution::Polygon_t newpolygon = | 
|---|
| 304 | SPD.get<7>(); | 
|---|
| 305 | SphericalPointDistribution::Polygon_t expected = newpolygon; | 
|---|
| 306 | expected.pop_front(); // remove first point | 
|---|
| 307 | SphericalPointDistribution::Polygon_t remaining = | 
|---|
| 308 | SphericalPointDistribution::matchSphericalPointDistributions( | 
|---|
| 309 | polygon, | 
|---|
| 310 | newpolygon); | 
|---|
| 311 | CPPUNIT_ASSERT_EQUAL( expected, remaining ); | 
|---|
| 312 | } | 
|---|
| 313 | } | 
|---|
| 314 |  | 
|---|
| 315 | /** UnitTest for matchSphericalPointDistributions() with eight points | 
|---|
| 316 | */ | 
|---|
| 317 | void SphericalPointDistributionTest::matchSphericalPointDistributionsTest_8() | 
|---|
| 318 | { | 
|---|
| 319 | SphericalPointDistribution SPD(1.); | 
|---|
| 320 |  | 
|---|
| 321 | // test with one point, matching trivially | 
|---|
| 322 | { | 
|---|
| 323 | SphericalPointDistribution::Polygon_t polygon; | 
|---|
| 324 | polygon += Vector(1.,0.,0.); | 
|---|
| 325 | SphericalPointDistribution::Polygon_t newpolygon = | 
|---|
| 326 | SPD.get<8>(); | 
|---|
| 327 | SphericalPointDistribution::Polygon_t expected = newpolygon; | 
|---|
| 328 | expected.pop_front(); // remove first point | 
|---|
| 329 | SphericalPointDistribution::Polygon_t remaining = | 
|---|
| 330 | SphericalPointDistribution::matchSphericalPointDistributions( | 
|---|
| 331 | polygon, | 
|---|
| 332 | newpolygon); | 
|---|
| 333 | CPPUNIT_ASSERT_EQUAL( expected, remaining ); | 
|---|
| 334 | } | 
|---|
| 335 |  | 
|---|
| 336 | // test with one point, just a flip of axis | 
|---|
| 337 | { | 
|---|
| 338 | SphericalPointDistribution::Polygon_t polygon; | 
|---|
| 339 | polygon += Vector(0.,1.,0.); | 
|---|
| 340 | SphericalPointDistribution::Polygon_t newpolygon = | 
|---|
| 341 | SPD.get<8>(); | 
|---|
| 342 | SphericalPointDistribution::Polygon_t expected = newpolygon; | 
|---|
| 343 | expected.pop_front(); // remove first point | 
|---|
| 344 | SphericalPointDistribution::Polygon_t remaining = | 
|---|
| 345 | SphericalPointDistribution::matchSphericalPointDistributions( | 
|---|
| 346 | polygon, | 
|---|
| 347 | newpolygon); | 
|---|
| 348 | CPPUNIT_ASSERT_EQUAL( expected, remaining ); | 
|---|
| 349 | } | 
|---|
| 350 | } | 
|---|