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36 # Make a static library for test infrastructure code that we re-use
37 # in multiple test executables across the repository.
38 gmx_add_unit_test_library(mdrun_test_infrastructure
42 simulatorcomparison.cpp
44 trajectorycomparison.cpp
46 # pseudo-library for code for mdrun
47 $<TARGET_OBJECTS:mdrun_objlib>
49 target_include_directories(mdrun_test_infrastructure SYSTEM PRIVATE ${PROJECT_SOURCE_DIR}/src/external)
50 target_link_libraries(mdrun_test_infrastructure PUBLIC legacy_api)
52 # To avoid running into test timeouts, some end-to-end tests of mdrun
53 # functionality are split off. This can be rearranged in future as we
55 set(testname "MdrunOutputTests")
56 set(exename "mdrun-output-test")
58 gmx_add_gtest_executable(${exename}
60 compressed_x_output.cpp
63 trajectory_writing.cpp
64 # pseudo-library for code for mdrun
65 $<TARGET_OBJECTS:mdrun_objlib>
67 target_link_libraries(${exename} PRIVATE mdrun_test_infrastructure)
68 gmx_register_gtest_test(${testname} ${exename} OPENMP_THREADS 2 INTEGRATION_TEST IGNORE_LEAKS)
70 set(testname "MdrunModulesTests")
71 set(exename "mdrun-modules-test")
73 gmx_add_gtest_executable(${exename}
75 densityfittingmodule.cpp
78 # pseudo-library for code for mdrun
79 $<TARGET_OBJECTS:mdrun_objlib>
81 target_link_libraries(${exename} PRIVATE mdrun_test_infrastructure)
82 gmx_register_gtest_test(${testname} ${exename} OPENMP_THREADS 2 INTEGRATION_TEST IGNORE_LEAKS)
84 set(testname "MdrunIOTests")
85 set(exename "mdrun-io-test")
87 gmx_add_gtest_executable(${exename}
91 initialconstraints.cpp
93 # pseudo-library for code for mdrun
94 $<TARGET_OBJECTS:mdrun_objlib>
96 target_link_libraries(${exename} PRIVATE mdrun_test_infrastructure)
97 gmx_register_gtest_test(${testname} ${exename} OPENMP_THREADS 2 INTEGRATION_TEST IGNORE_LEAKS)
99 # To avoid running into test timeouts, some end-to-end tests of mdrun
100 # functionality are split off. This can be rearranged in future as we
102 set(testname "MdrunTests")
103 set(exename "mdrun-test")
105 gmx_add_gtest_executable(${exename}
108 multiple_time_stepping.cpp
112 tabulated_bonded_interactions.cpp
113 # pseudo-library for code for mdrun
114 $<TARGET_OBJECTS:mdrun_objlib>
116 target_link_libraries(${exename} PRIVATE mdrun_test_infrastructure)
117 gmx_register_gtest_test(${testname} ${exename} OPENMP_THREADS 2 INTEGRATION_TEST IGNORE_LEAKS)
120 set(testname "MdrunPmeTests")
121 set(exename "mdrun-pme-test")
123 gmx_add_gtest_executable(${exename}
126 # pseudo-library for code for mdrun
127 $<TARGET_OBJECTS:mdrun_objlib>
129 target_link_libraries(${exename} PRIVATE mdrun_test_infrastructure)
130 gmx_register_gtest_test(${testname} ${exename} OPENMP_THREADS 2 INTEGRATION_TEST IGNORE_LEAKS)
133 set(testname "MdrunNonIntegratorTests")
134 set(exename "mdrun-non-integrator-test")
136 gmx_add_gtest_executable(${exename}
138 # files with code for tests
144 # pseudo-library for code for mdrun
145 $<TARGET_OBJECTS:mdrun_objlib>
147 target_link_libraries(${exename} PRIVATE mdrun_test_infrastructure)
148 gmx_register_gtest_test(${testname} ${exename} OPENMP_THREADS 2 INTEGRATION_TEST IGNORE_LEAKS)
150 # TPI does not support OpenMP, so we need a separate test binary
151 set(testname "MdrunTpiTests")
152 set(exename "mdrun-tpi-test")
154 gmx_add_gtest_executable(${exename}
156 # files with code for tests
158 # pseudo-library for code for mdrun
159 $<TARGET_OBJECTS:mdrun_objlib>
161 target_link_libraries(${exename} PRIVATE mdrun_test_infrastructure)
162 gmx_register_gtest_test(${testname} ${exename} INTEGRATION_TEST IGNORE_LEAKS)
164 # Tests that only make sense to run with multiple ranks and/or real
165 # MPI are implemented here.
166 set(testname "MdrunMpiTests")
167 set(exename "mdrun-mpi-test")
169 gmx_add_gtest_executable(${exename} MPI
171 # files with code for tests
172 domain_decomposition.cpp
179 # pseudo-library for code for mdrun
180 $<TARGET_OBJECTS:mdrun_objlib>
182 target_link_libraries(${exename} PRIVATE mdrun_test_infrastructure)
183 gmx_register_gtest_test(${testname} ${exename} MPI_RANKS 2 OPENMP_THREADS 2 INTEGRATION_TEST IGNORE_LEAKS)
185 # Tests that only make sense to run with multiple ranks and/or real
186 # MPI are implemented here. Special case for slow PME tests
187 set(testname "MdrunMpiPmeTests")
188 set(exename "mdrun-mpi-pme-test")
190 gmx_add_gtest_executable(${exename} MPI
192 # files with code for tests
194 # pseudo-library for code for mdrun
195 $<TARGET_OBJECTS:mdrun_objlib>
197 target_link_libraries(${exename} PRIVATE mdrun_test_infrastructure)
198 gmx_register_gtest_test(${testname} ${exename} MPI_RANKS 2 OPENMP_THREADS 2 INTEGRATION_TEST IGNORE_LEAKS)
200 # Slow-running tests that target testing multiple-rank coordination behaviors
201 set(exename "mdrun-mpi-coordination-test")
202 gmx_add_gtest_executable(${exename} MPI
204 # files with code for tests
206 # pseudo-library for code for mdrun
207 $<TARGET_OBJECTS:mdrun_objlib>
209 target_link_libraries(${exename} PRIVATE mdrun_test_infrastructure)
211 # These tests are extremely slow without optimization or OpenMP, so only run them for
212 # build types like Release or RelWithDebInfo and if the build has been configured
213 # with OpenMP enabled.
214 if (CMAKE_BUILD_TYPE MATCHES "Rel" AND GMX_OPENMP)
215 set(testname "MdrunMpiCoordinationTestsOneRank")
216 gmx_register_gtest_test(${testname} ${exename} MPI_RANKS 1 SLOW_TEST IGNORE_LEAKS)
217 set(testname "MdrunMpiCoordinationTestsTwoRanks")
218 gmx_register_gtest_test(${testname} ${exename} MPI_RANKS 2 SLOW_TEST IGNORE_LEAKS)
221 # Keeping the FEP tests separate for now to be able to judge runtime more easily
222 # Can be included in mdrun tests later
223 set(testname "MdrunFEPTests")
224 set(exename "mdrunfep-test")
226 gmx_add_gtest_executable(${exename}
228 # files with code for tests
230 # pseudo-library for code for mdrun
231 $<TARGET_OBJECTS:mdrun_objlib>
233 target_link_libraries(${exename} PRIVATE mdrun_test_infrastructure)
234 # TODO: Link specific modules: topology
235 target_link_libraries(${exename} PRIVATE legacy_modules)
236 gmx_register_gtest_test(${testname} ${exename} OPENMP_THREADS 2 INTEGRATION_TEST IGNORE_LEAKS)