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37 * Tests for functionality of analysis data averaging modules.
39 * These tests check that gmx::AnalysisDataAverageModule and
40 * gmx::AnalysisDataFrameAverageModule compute averages correctly with simple
42 * Checking is done using gmx::test::AnalysisDataTestFixture and reference
43 * data. Also the input data is written to the reference data to catch
44 * out-of-date reference.
46 * \author Teemu Murtola <teemu.murtola@gmail.com>
47 * \ingroup module_analysisdata
51 #include "gromacs/analysisdata/modules/average.h"
53 #include <gtest/gtest.h>
55 #include "gromacs/analysisdata/analysisdata.h"
57 #include "gromacs/analysisdata/tests/datatest.h"
58 #include "testutils/testasserts.h"
60 using gmx::test::AnalysisDataTestInput;
65 // Simple input data for gmx::AnalysisDataAverageModule tests.
69 static const AnalysisDataTestInput& get()
71 #ifndef STATIC_ANON_NAMESPACE_BUG
72 static SimpleInputData singleton;
73 return singleton.data_;
75 static SimpleInputData singleton_average;
76 return singleton_average.data_;
80 SimpleInputData() : data_(1, false)
82 data_.setColumnCount(0, 3);
83 data_.addFrameWithValues(1.0, 0.0, 1.0, 2.0);
84 data_.addFrameWithValues(2.0, 1.0, 1.0, 1.0);
85 data_.addFrameWithValues(3.0, 2.0, 0.0, 0.0);
89 AnalysisDataTestInput data_;
92 // Multipoint input data for gmx::AnalysisDataAverageModule tests.
93 class MultipointInputData
96 static const AnalysisDataTestInput& get()
98 #ifndef STATIC_ANON_NAMESPACE_BUG
99 static MultipointInputData singleton;
100 return singleton.data_;
102 static MultipointInputData singleton_average;
103 return singleton_average.data_;
107 MultipointInputData() : data_(1, true)
109 using gmx::test::AnalysisDataTestInputFrame;
110 data_.setColumnCount(0, 3);
111 AnalysisDataTestInputFrame& frame1 = data_.addFrame(1.0);
112 frame1.addPointSetWithValues(0, 0, 0.0, 1.0, 2.0);
113 frame1.addPointSetWithValues(0, 0, 1.0, 0.0);
114 frame1.addPointSetWithValues(0, 0, 2.0);
115 AnalysisDataTestInputFrame& frame2 = data_.addFrame(2.0);
116 frame2.addPointSetWithValues(0, 0, 1.0, 1.0);
117 frame2.addPointSetWithValues(0, 0, 2.0);
118 AnalysisDataTestInputFrame& frame3 = data_.addFrame(3.0);
119 frame3.addPointSetWithValues(0, 0, 2.0, 0.0, 0.0);
123 AnalysisDataTestInput data_;
126 // Input data with multiple data sets for gmx::AnalysisDataAverageModule tests.
127 class MultiDataSetInputData
130 static const AnalysisDataTestInput& get()
132 #ifndef STATIC_ANON_NAMESPACE_BUG
133 static MultiDataSetInputData singleton;
134 return singleton.data_;
136 static MultiDataSetInputData singleton_average;
137 return singleton_average.data_;
141 MultiDataSetInputData() : data_(2, true)
143 using gmx::test::AnalysisDataTestInputFrame;
144 data_.setColumnCount(0, 3);
145 data_.setColumnCount(1, 2);
146 AnalysisDataTestInputFrame& frame1 = data_.addFrame(1.0);
147 frame1.addPointSetWithValues(0, 0, 0.0, 1.0, 2.0);
148 frame1.addPointSetWithValues(0, 0, 1.0, 0.0);
149 frame1.addPointSetWithValues(1, 0, 2.0, 1.0);
150 frame1.addPointSetWithValues(1, 1, 2.0);
151 AnalysisDataTestInputFrame& frame2 = data_.addFrame(2.0);
152 frame2.addPointSetWithValues(0, 0, 1.0, 1.0);
153 frame2.addPointSetWithValues(0, 2, 2.0);
154 frame2.addPointSetWithValues(1, 0, 1.0, 0.0);
155 AnalysisDataTestInputFrame& frame3 = data_.addFrame(3.0);
156 frame3.addPointSetWithValues(0, 0, 2.0, 0.0, 0.0);
157 frame3.addPointSetWithValues(1, 0, 0.0, 2.0);
161 AnalysisDataTestInput data_;
165 /********************************************************************
166 * Tests for gmx::AnalysisDataAverageModule.
169 //! Test fixture for gmx::AnalysisDataAverageModule.
170 typedef gmx::test::AnalysisDataTestFixture AverageModuleTest;
172 TEST_F(AverageModuleTest, BasicTest)
174 const AnalysisDataTestInput& input = SimpleInputData::get();
175 gmx::AnalysisData data;
176 ASSERT_NO_THROW_GMX(setupDataObject(input, &data));
178 gmx::AnalysisDataAverageModulePointer module(new gmx::AnalysisDataAverageModule);
179 data.addModule(module);
181 ASSERT_NO_THROW_GMX(addStaticCheckerModule(input, &data));
182 ASSERT_NO_THROW_GMX(addReferenceCheckerModule("InputData", &data));
183 ASSERT_NO_THROW_GMX(addReferenceCheckerModule("Average", module.get()));
184 ASSERT_NO_THROW_GMX(presentAllData(input, &data));
187 TEST_F(AverageModuleTest, HandlesMultipointData)
189 const AnalysisDataTestInput& input = MultipointInputData::get();
190 gmx::AnalysisData data;
191 ASSERT_NO_THROW_GMX(setupDataObject(input, &data));
193 gmx::AnalysisDataAverageModulePointer module(new gmx::AnalysisDataAverageModule);
194 data.addModule(module);
196 ASSERT_NO_THROW_GMX(addStaticCheckerModule(input, &data));
197 ASSERT_NO_THROW_GMX(addReferenceCheckerModule("InputData", &data));
198 ASSERT_NO_THROW_GMX(addReferenceCheckerModule("Average", module.get()));
199 ASSERT_NO_THROW_GMX(presentAllData(input, &data));
202 TEST_F(AverageModuleTest, HandlesMultipleDataSets)
204 const AnalysisDataTestInput& input = MultiDataSetInputData::get();
205 gmx::AnalysisData data;
206 ASSERT_NO_THROW_GMX(setupDataObject(input, &data));
208 gmx::AnalysisDataAverageModulePointer module(new gmx::AnalysisDataAverageModule);
209 data.addModule(module);
211 ASSERT_NO_THROW_GMX(addStaticCheckerModule(input, &data));
212 ASSERT_NO_THROW_GMX(addReferenceCheckerModule("InputData", &data));
213 ASSERT_NO_THROW_GMX(addReferenceCheckerModule("Average", module.get()));
214 ASSERT_NO_THROW_GMX(presentAllData(input, &data));
217 TEST_F(AverageModuleTest, HandlesDataSetAveraging)
219 const AnalysisDataTestInput& input = MultiDataSetInputData::get();
220 gmx::AnalysisData data;
221 ASSERT_NO_THROW_GMX(setupDataObject(input, &data));
223 gmx::AnalysisDataAverageModulePointer module(new gmx::AnalysisDataAverageModule);
224 module->setAverageDataSets(true);
225 data.addModule(module);
227 ASSERT_NO_THROW_GMX(addStaticCheckerModule(input, &data));
228 ASSERT_NO_THROW_GMX(addReferenceCheckerModule("InputData", &data));
229 ASSERT_NO_THROW_GMX(addReferenceCheckerModule("Average", module.get()));
230 ASSERT_NO_THROW_GMX(presentAllData(input, &data));
233 TEST_F(AverageModuleTest, CanCustomizeXAxis)
235 const AnalysisDataTestInput& input = SimpleInputData::get();
236 gmx::AnalysisData data;
237 ASSERT_NO_THROW_GMX(setupDataObject(input, &data));
239 gmx::AnalysisDataAverageModulePointer module(new gmx::AnalysisDataAverageModule());
240 data.addModule(module);
241 module->setXAxis(0.5, 0.5);
243 ASSERT_NO_THROW_GMX(addStaticCheckerModule(input, &data));
244 ASSERT_NO_THROW_GMX(addReferenceCheckerModule("InputData", &data));
245 ASSERT_NO_THROW_GMX(addReferenceCheckerModule("Average", module.get()));
246 ASSERT_NO_THROW_GMX(presentAllData(input, &data));
249 TEST_F(AverageModuleTest, CanCustomizeNonUniformXAxis)
251 const AnalysisDataTestInput& input = SimpleInputData::get();
252 gmx::AnalysisData data;
253 ASSERT_NO_THROW_GMX(setupDataObject(input, &data));
255 gmx::AnalysisDataAverageModulePointer module(new gmx::AnalysisDataAverageModule());
256 data.addModule(module);
257 module->setXAxisValue(0, 2.0);
258 module->setXAxisValue(1, 3.0);
259 module->setXAxisValue(2, 5.0);
261 ASSERT_NO_THROW_GMX(addStaticCheckerModule(input, &data));
262 ASSERT_NO_THROW_GMX(addReferenceCheckerModule("InputData", &data));
263 ASSERT_NO_THROW_GMX(addReferenceCheckerModule("Average", module.get()));
264 ASSERT_NO_THROW_GMX(presentAllData(input, &data));
267 /********************************************************************
268 * Tests for gmx::AnalysisDataFrameAverageModule.
271 //! Test fixture for gmx::AnalysisDataFrameAverageModule.
272 typedef gmx::test::AnalysisDataTestFixture FrameAverageModuleTest;
274 TEST_F(FrameAverageModuleTest, BasicTest)
276 const AnalysisDataTestInput& input = SimpleInputData::get();
277 gmx::AnalysisData data;
278 ASSERT_NO_THROW_GMX(setupDataObject(input, &data));
280 gmx::AnalysisDataFrameAverageModulePointer module(new gmx::AnalysisDataFrameAverageModule);
281 data.addModule(module);
283 ASSERT_NO_THROW_GMX(addStaticCheckerModule(input, &data));
284 ASSERT_NO_THROW_GMX(addReferenceCheckerModule("InputData", &data));
285 ASSERT_NO_THROW_GMX(addReferenceCheckerModule("FrameAverage", module.get()));
286 ASSERT_NO_THROW_GMX(presentAllData(input, &data));
289 TEST_F(FrameAverageModuleTest, HandlesMultipleDataSets)
291 const AnalysisDataTestInput& input = MultiDataSetInputData::get();
292 gmx::AnalysisData data;
293 ASSERT_NO_THROW_GMX(setupDataObject(input, &data));
295 gmx::AnalysisDataFrameAverageModulePointer module(new gmx::AnalysisDataFrameAverageModule);
296 data.addModule(module);
298 ASSERT_NO_THROW_GMX(addStaticCheckerModule(input, &data));
299 ASSERT_NO_THROW_GMX(addReferenceCheckerModule("InputData", &data));
300 ASSERT_NO_THROW_GMX(addReferenceCheckerModule("FrameAverage", module.get()));
301 ASSERT_NO_THROW_GMX(presentAllData(input, &data));