[bcf653] | 1 | /*
|
---|
| 2 | * Project: MoleCuilder
|
---|
| 3 | * Description: creates and alters molecular systems
|
---|
[6d608d] | 4 | * Copyright (C) 2010-2012 University of Bonn. All rights reserved.
|
---|
[94d5ac6] | 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/>.
|
---|
[bcf653] | 21 | */
|
---|
| 22 |
|
---|
[f60610] | 23 | /*
|
---|
[78b593] | 24 | * LinearSystemOfEquationsunittest.cpp
|
---|
[f60610] | 25 | *
|
---|
| 26 | * Created on: Jan 8, 2010
|
---|
| 27 | * Author: heber
|
---|
| 28 | */
|
---|
| 29 |
|
---|
[bf3817] | 30 | // include config.h
|
---|
| 31 | #ifdef HAVE_CONFIG_H
|
---|
| 32 | #include <config.h>
|
---|
| 33 | #endif
|
---|
| 34 |
|
---|
[f60610] | 35 | using namespace std;
|
---|
| 36 |
|
---|
[9b410d] | 37 | #include <limits>
|
---|
[f60610] | 38 | #include <cppunit/CompilerOutputter.h>
|
---|
| 39 | #include <cppunit/extensions/TestFactoryRegistry.h>
|
---|
| 40 | #include <cppunit/ui/text/TestRunner.h>
|
---|
[3dcb1f] | 41 | #include <cmath>
|
---|
[f60610] | 42 |
|
---|
[bf4b9f] | 43 | #include "defs.hpp"
|
---|
| 44 | #include "Vector.hpp"
|
---|
[f60610] | 45 |
|
---|
[78b593] | 46 | #include "LinearSystemOfEquationsUnitTest.hpp"
|
---|
| 47 |
|
---|
[9b6b2f] | 48 | #ifdef HAVE_TESTRUNNER
|
---|
| 49 | #include "UnitTestMain.hpp"
|
---|
| 50 | #endif /*HAVE_TESTRUNNER*/
|
---|
| 51 |
|
---|
[f60610] | 52 | /********************************************** Test classes **************************************/
|
---|
| 53 |
|
---|
| 54 | // Registers the fixture into the 'registry'
|
---|
| 55 | CPPUNIT_TEST_SUITE_REGISTRATION( LinearSystemOfEquationsTest );
|
---|
| 56 |
|
---|
| 57 |
|
---|
| 58 | void LinearSystemOfEquationsTest::setUp()
|
---|
| 59 | {
|
---|
| 60 | s = new LinearSystemOfEquations(4,4);
|
---|
| 61 | };
|
---|
| 62 |
|
---|
| 63 | void LinearSystemOfEquationsTest::tearDown()
|
---|
| 64 | {
|
---|
| 65 | delete(s);
|
---|
| 66 | };
|
---|
| 67 |
|
---|
| 68 | /** Unit test for initialization.
|
---|
| 69 | *
|
---|
| 70 | */
|
---|
| 71 | void LinearSystemOfEquationsTest::InitializationTest()
|
---|
| 72 | {
|
---|
| 73 | // Setting A
|
---|
| 74 | double array[] = { 1., 0., 0., 0.,
|
---|
| 75 | 0., 2., 0., 0.,
|
---|
| 76 | 0., 0., 3., 0.,
|
---|
| 77 | 0., 0., 0., 4. };
|
---|
| 78 | s->SetA(array);
|
---|
| 79 |
|
---|
| 80 | // Setting b
|
---|
| 81 | };
|
---|
| 82 |
|
---|
| 83 | /** Unit test for symmetry property.
|
---|
| 84 | *
|
---|
| 85 | */
|
---|
| 86 | void LinearSystemOfEquationsTest::SymmetricTest()
|
---|
| 87 | {
|
---|
| 88 | CPPUNIT_ASSERT_EQUAL( true, s->SetSymmetric(true) );
|
---|
| 89 | //LinearSystemOfEquations *t = new LinearSystemOfEquations(4,3);
|
---|
| 90 | //CPPUNIT_ASSERT_EQUAL( true, t->SetSymmetric(true) );
|
---|
| 91 | //delete(t);
|
---|
| 92 | };
|
---|
| 93 |
|
---|
| 94 | /** Unit test for simple Solve.
|
---|
| 95 | *
|
---|
| 96 | */
|
---|
| 97 | void LinearSystemOfEquationsTest::SolveSimpleTest()
|
---|
| 98 | {
|
---|
| 99 | // set up A and b
|
---|
| 100 | double m_array[] = { 1., 0., 0., 0.,
|
---|
| 101 | 0., 2., 0., 0.,
|
---|
| 102 | 0., 0., 3., 0.,
|
---|
| 103 | 0., 0., 0., 4. };
|
---|
| 104 | double v_array[] = { 1., 2., 3., 4. };
|
---|
| 105 | s->SetA(m_array);
|
---|
| 106 | s->Setb(v_array);
|
---|
| 107 |
|
---|
| 108 | // solve
|
---|
| 109 | double *array = new double[4];
|
---|
| 110 | s->GetSolutionAsArray(array);
|
---|
| 111 | for (int i=0;i<4;i++)
|
---|
| 112 | CPPUNIT_ASSERT_EQUAL( 1., array[i]);
|
---|
| 113 | delete[](array);
|
---|
| 114 | };
|
---|
| 115 |
|
---|
| 116 | /** Unit test for advanced Solve.
|
---|
| 117 | *
|
---|
| 118 | */
|
---|
| 119 | void LinearSystemOfEquationsTest::SolveAdvancedTest()
|
---|
| 120 | {
|
---|
| 121 | // set up A and b
|
---|
| 122 | double m_array[] = { 0.18, 0.60, 0.57, 0.96,
|
---|
| 123 | 0.41, 0.24, 0.99, 0.58,
|
---|
| 124 | 0.14, 0.30, 0.97, 0.66,
|
---|
| 125 | 0.51, 0.13, 0.19, 0.85 };
|
---|
| 126 | double v_array[] = { 1.0, 2.0, 3.0, 4.0 };
|
---|
| 127 | double x_array[] = { -4.05205022957398, -12.60561139590692, 1.660911626708844, 8.693766928795233 };
|
---|
| 128 | s->SetA(m_array);
|
---|
| 129 | s->Setb(v_array);
|
---|
| 130 |
|
---|
| 131 | // solve
|
---|
| 132 | double *array = new double[4];
|
---|
| 133 | s->GetSolutionAsArray(array);
|
---|
| 134 | for (int i=0;i<4;i++) {
|
---|
[71129f] | 135 | CPPUNIT_ASSERT( fabs(x_array[i] - array[i]) <= LINALG_MYEPSILON() );
|
---|
[f60610] | 136 | }
|
---|
| 137 | delete[](array);
|
---|
| 138 | };
|
---|