source: src/Fragmentation/Exporters/unittests/HydrogenPoolUnitTest.cpp@ 830b3e

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Last change on this file since 830b3e was c3df23, checked in by Frederik Heber <heber@…>, 12 years ago

Added HydrogenPool for controlling a set of saturation hydrogens.

  • Property mode set to 100644
File size: 4.7 KB
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1/*
2 * Project: MoleCuilder
3 * Description: creates and alters molecular systems
4 * Copyright (C) 2013 University of Bonn. 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 * HydrogenPoolUnitTest.cpp
25 *
26 * Created on: Mar 03, 2013
27 * Author: heber
28 */
29
30// include config.h
31#ifdef HAVE_CONFIG_H
32#include <config.h>
33#endif
34
35using 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 "HydrogenPoolUnitTest.hpp"
46
47#include "CodePatterns/Assert.hpp"
48
49#include "Fragmentation/Exporters/HydrogenPool.hpp"
50#include "World.hpp"
51
52#ifdef HAVE_TESTRUNNER
53#include "UnitTestMain.hpp"
54#endif /*HAVE_TESTRUNNER*/
55
56/********************************************** Test classes **************************************/
57
58// Registers the fixture into the 'registry'
59CPPUNIT_TEST_SUITE_REGISTRATION( HydrogenPoolTest );
60
61
62void HydrogenPoolTest::setUp()
63{
64 // failing asserts should be thrown
65 ASSERT_DO(Assert::Throw);
66
67 pool = new HydrogenPool();
68}
69
70
71void HydrogenPoolTest::tearDown()
72{
73 delete pool;
74
75 World::purgeInstance();
76}
77
78/** UnitTest for leaseHydrogen() and releaseHydrogen.
79 */
80void HydrogenPoolTest::lease_releaseHydrogen_Test()
81{
82 // check simple test
83 {
84 CPPUNIT_ASSERT_EQUAL( 0, World::getInstance().numAtoms() );
85 atom * const Walker = pool->leaseHydrogen();
86 CPPUNIT_ASSERT( pool->HydrogenQueue.empty() );
87 CPPUNIT_ASSERT( !pool->HydrogenInUse.empty() );
88 CPPUNIT_ASSERT_EQUAL( 1, World::getInstance().numAtoms() );
89 pool->releaseHydrogen(Walker);
90 CPPUNIT_ASSERT( !pool->HydrogenQueue.empty() );
91 CPPUNIT_ASSERT( pool->HydrogenInUse.empty() );
92 pool->cleanup();
93 CPPUNIT_ASSERT_EQUAL( 0, World::getInstance().numAtoms() );
94 }
95 // check via id test
96 {
97 CPPUNIT_ASSERT_EQUAL( 0, World::getInstance().numAtoms() );
98 atom * const Walker = pool->leaseHydrogen();
99 CPPUNIT_ASSERT( pool->HydrogenQueue.empty() );
100 CPPUNIT_ASSERT( !pool->HydrogenInUse.empty() );
101 CPPUNIT_ASSERT_EQUAL( 1, World::getInstance().numAtoms() );
102 pool->releaseHydrogen(Walker->getId());
103 CPPUNIT_ASSERT( !pool->HydrogenQueue.empty() );
104 CPPUNIT_ASSERT( pool->HydrogenInUse.empty() );
105 pool->cleanup();
106 CPPUNIT_ASSERT_EQUAL( 0, World::getInstance().numAtoms() );
107 }
108 // check that can't cleanup with leased atoms
109 {
110 CPPUNIT_ASSERT_EQUAL( 0, World::getInstance().numAtoms() );
111 atom * const Walker = pool->leaseHydrogen();
112 std::cerr << "The following assertion is intended and does not entail a failure of the test." << std::endl;
113#ifndef NDEBUG
114 CPPUNIT_ASSERT_THROW(pool->cleanup(), Assert::AssertionFailure );
115#else
116 pool->cleanup();
117#endif
118 CPPUNIT_ASSERT_EQUAL( 1, World::getInstance().numAtoms() );
119 pool->releaseHydrogen(Walker);
120 pool->cleanup();
121 CPPUNIT_ASSERT_EQUAL( 0, World::getInstance().numAtoms() );
122 }
123 // check returning from atom
124 {
125 CPPUNIT_ASSERT_EQUAL( 0, World::getInstance().numAtoms() );
126 atom * const Walker = pool->leaseHydrogen();
127 CPPUNIT_ASSERT_EQUAL( 1, World::getInstance().numAtoms() );
128 atom * const InvalidWalker = NULL;
129 std::cerr << "The following assertion is intended and does not entail a failure of the test." << std::endl;
130#ifndef NDEBUG
131 CPPUNIT_ASSERT_THROW(pool->releaseHydrogen(InvalidWalker), Assert::AssertionFailure );
132#else
133 pool->releaseHydrogen(InvalidWalker);
134#endif
135 CPPUNIT_ASSERT_EQUAL( 1, World::getInstance().numAtoms() );
136 pool->releaseHydrogen(Walker);
137 pool->cleanup();
138 CPPUNIT_ASSERT_EQUAL( 0, World::getInstance().numAtoms() );
139 }
140}
141
142/** UnitTest for requestHydrogen().
143 */
144void HydrogenPoolTest::requestHydrogen_Test()
145{
146 CPPUNIT_ASSERT_EQUAL( 0, World::getInstance().numAtoms() );
147 pool->requestHydrogenIntoPool();
148 CPPUNIT_ASSERT( !pool->HydrogenQueue.empty() );
149 CPPUNIT_ASSERT_EQUAL( 1, World::getInstance().numAtoms() );
150 pool->cleanup();
151 CPPUNIT_ASSERT_EQUAL( 0, World::getInstance().numAtoms() );
152}
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