source: src/unittests/AtomIdSetUnitTest.cpp@ 4464ef

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Last change on this file since 4464ef was f01769, checked in by Frederik Heber <heber@…>, 9 years ago

Replaced World::getAtom() wherever possible by const version.

  • some AtomSet member functions now have const atom ptr instead of atom ptr.
  • molecule can return const and non-const AtomSet.
  • added FromIdToConstAtom to allow iterate through atoms in molecule (which are stored by id, not by ptr) in const fashion.
  • in molecule::isInMolecule() is now const, ::CopyMolecule..() is non-const (because copying involves father atom who is stored non-const).
  • Property mode set to 100644
File size: 4.8 KB
Line 
1/*
2 * Project: MoleCuilder
3 * Description: creates and alters molecular systems
4 * Copyright (C) 2012 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 * AtomIdSetUnitTest.cpp
25 *
26 * Created on: Feb 21, 2012
27 * Author: heber
28 */
29
30// include config.h
31#ifdef HAVE_CONFIG_H
32#include <config.h>
33#endif
34
35#include <cppunit/CompilerOutputter.h>
36#include <cppunit/extensions/TestFactoryRegistry.h>
37#include <cppunit/ui/text/TestRunner.h>
38
39#include <algorithm>
40
41#include "Atom/atom.hpp"
42#include "AtomIdSet.hpp"
43#include "CodePatterns/Assert.hpp"
44#include "World.hpp"
45
46#include "AtomIdSetUnitTest.hpp"
47
48
49#ifdef HAVE_TESTRUNNER
50#include "UnitTestMain.hpp"
51#endif /*HAVE_TESTRUNNER*/
52
53/********************************************** Test classes **************************************/
54
55// Registers the fixture into the 'registry'
56CPPUNIT_TEST_SUITE_REGISTRATION( AtomIdSetUnittest );
57
58size_t AtomIdSetUnittest::MaxAtoms = 6;
59
60void AtomIdSetUnittest::setUp(){
61 // failing asserts should be thrown
62 ASSERT_DO(Assert::Throw);
63
64 atomVector.resize((size_t)MaxAtoms);
65 std::generate_n(atomVector.begin(), MaxAtoms,
66 boost::bind(&World::createAtom, boost::ref(World::getInstance())));
67}
68
69void AtomIdSetUnittest::tearDown()
70{
71 World::purgeInstance();
72}
73
74void AtomIdSetUnittest::inserteraseTest()
75{
76 // insert all
77 for (size_t i=0; i< MaxAtoms; ++i) {
78 atoms.insert(atomVector[i]);
79 }
80 CPPUNIT_ASSERT_EQUAL( (size_t)MaxAtoms, atoms.size() );
81
82 // erase them again
83 for (size_t i=0; i< MaxAtoms; ++i) {
84 atoms.erase(atomVector[i]);
85 }
86 CPPUNIT_ASSERT_EQUAL( (size_t)0, atoms.size() );
87
88 {
89 // use atomVector in cstor
90 AtomIdSet otherAtoms(atomVector);
91 CPPUNIT_ASSERT_EQUAL( (size_t)MaxAtoms, otherAtoms.size() );
92 }
93}
94
95void AtomIdSetUnittest::positionTest()
96{
97 // non-const iterators
98 CPPUNIT_ASSERT( atoms.begin() == atoms.end() );
99
100 // const iterators
101 {
102 AtomIdSet::const_iterator beg_iter = const_cast<const AtomIdSet &>(atoms).begin();
103 AtomIdSet::const_iterator end_iter = const_cast<const AtomIdSet &>(atoms).end();
104 CPPUNIT_ASSERT( beg_iter == end_iter );
105 }
106
107 // insert an element
108 atoms.insert(atomVector[0]);
109 CPPUNIT_ASSERT( atoms.begin() != atoms.end() );
110
111 {
112 AtomIdSet::const_iterator beg_iter = const_cast<const AtomIdSet &>(atoms).begin();
113 AtomIdSet::const_iterator end_iter = const_cast<const AtomIdSet &>(atoms).end();
114 CPPUNIT_ASSERT( beg_iter != end_iter );
115 ++beg_iter;
116 CPPUNIT_ASSERT( beg_iter == end_iter );
117 }
118}
119
120void AtomIdSetUnittest::containsTest()
121{
122 // search for atom
123 atoms.insert(atomVector[0]);
124 CPPUNIT_ASSERT( atoms.contains(atomVector[0]) );
125 atoms.erase(atomVector[0]);
126 CPPUNIT_ASSERT( !atoms.contains(atomVector[0]) );
127
128 // search for key
129 atoms.insert(atomVector[0]->getId());
130 CPPUNIT_ASSERT( atoms.contains(atomVector[0]->getId()) );
131 atoms.erase(atomVector[0]->getId());
132 CPPUNIT_ASSERT( !atoms.contains(atomVector[0]->getId()) );
133}
134
135void AtomIdSetUnittest::findTest()
136{
137 // search for atom
138 atoms.insert(atomVector[0]);
139 CPPUNIT_ASSERT( atoms.find(atomVector[0]) == const_cast<const AtomIdSet &>(atoms).begin() );
140 CPPUNIT_ASSERT( atoms.find(atomVector[0]) != const_cast<const AtomIdSet &>(atoms).end() );
141 atoms.erase(atomVector[0]);
142
143 // search for key
144 atoms.insert(atomVector[0]->getId());
145 CPPUNIT_ASSERT( atoms.find(atomVector[0]->getId()) == const_cast<const AtomIdSet &>(atoms).begin() );
146 CPPUNIT_ASSERT( atoms.find(atomVector[0]->getId()) != const_cast<const AtomIdSet &>(atoms).end() );
147 atoms.erase(atomVector[0]->getId());
148}
149
150
151void AtomIdSetUnittest::emptyTest()
152{
153 // initially empty
154 CPPUNIT_ASSERT( atoms.empty() );
155
156 // filled with one then no more
157 atoms.insert(atomVector[0]);
158 CPPUNIT_ASSERT( !atoms.empty() );
159
160 // erase and again empty
161 atoms.erase(atomVector[0]);
162 CPPUNIT_ASSERT( atoms.empty() );
163}
164
165void AtomIdSetUnittest::sizeTest()
166{
167 // initially empty
168 CPPUNIT_ASSERT_EQUAL( (size_t)0, atoms.size() );
169
170 // filled with one, then no more
171 atoms.insert(atomVector[0]);
172 CPPUNIT_ASSERT_EQUAL( (size_t)1, atoms.size() );
173
174 // erase and again empty
175 atoms.erase(atomVector[0]);
176 CPPUNIT_ASSERT_EQUAL( (size_t)0, atoms.size() );
177}
178
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