#--------------------------------------------------- # OpenMM CUDA Drude Integrator # # Creates OpenMMDrudeCUDA library. # # Windows: # OpenMMDrudeCUDA.dll # OpenMMDrudeCUDA.lib # Unix: # libOpenMMDrudeCUDA.so #---------------------------------------------------- # The source is organized into subdirectories, but we handle them all from # this CMakeLists file rather than letting CMake visit them as SUBDIRS. SET(OPENMM_SOURCE_SUBDIRS .) # Collect up information about the version of the OpenMM library we're building # and make it available to the code so it can be built into the binaries. SET(OPENMMDRUDECUDA_LIBRARY_NAME OpenMMDrudeCUDA) SET(SHARED_TARGET ${OPENMMDRUDECUDA_LIBRARY_NAME}) # These are all the places to search for header files which are # to be part of the API. SET(API_INCLUDE_DIRS) # start empty FOREACH(subdir ${OPENMM_SOURCE_SUBDIRS}) # append SET(API_INCLUDE_DIRS ${API_INCLUDE_DIRS} ${CMAKE_CURRENT_SOURCE_DIR}/${subdir}/include ${CMAKE_CURRENT_SOURCE_DIR}/${subdir}/include/internal) ENDFOREACH(subdir) # We'll need both *relative* path names, starting with their API_INCLUDE_DIRS, # and absolute pathnames. SET(API_REL_INCLUDE_FILES) # start these out empty SET(API_ABS_INCLUDE_FILES) FOREACH(dir ${API_INCLUDE_DIRS}) FILE(GLOB fullpaths ${dir}/*.h) # returns full pathnames SET(API_ABS_INCLUDE_FILES ${API_ABS_INCLUDE_FILES} ${fullpaths}) FOREACH(pathname ${fullpaths}) GET_FILENAME_COMPONENT(filename ${pathname} NAME) SET(API_REL_INCLUDE_FILES ${API_REL_INCLUDE_FILES} ${dir}/${filename}) ENDFOREACH(pathname) ENDFOREACH(dir) # collect up source files SET(SOURCE_FILES) # empty SET(SOURCE_INCLUDE_FILES) FOREACH(subdir ${OPENMM_SOURCE_SUBDIRS}) FILE(GLOB_RECURSE src_files ${CMAKE_CURRENT_SOURCE_DIR}/${subdir}/src/*.cpp ${CMAKE_CURRENT_SOURCE_DIR}/${subdir}/src/*.c) FILE(GLOB incl_files ${CMAKE_CURRENT_SOURCE_DIR}/${subdir}/src/*.h) SET(SOURCE_FILES ${SOURCE_FILES} ${src_files}) #append SET(SOURCE_INCLUDE_FILES ${SOURCE_INCLUDE_FILES} ${incl_files}) INCLUDE_DIRECTORIES(BEFORE ${CMAKE_CURRENT_SOURCE_DIR}/${subdir}/include) ENDFOREACH(subdir) INCLUDE_DIRECTORIES(BEFORE ${CMAKE_CURRENT_SOURCE_DIR}/src) INCLUDE_DIRECTORIES(BEFORE ${CMAKE_SOURCE_DIR}/platforms/cuda/include) INCLUDE_DIRECTORIES(BEFORE ${CMAKE_SOURCE_DIR}/platforms/cuda/src) INCLUDE_DIRECTORIES(BEFORE ${CMAKE_BINARY_DIR}/platforms/cuda/src) # Set variables needed for encoding kernel sources into a C++ class SET(CUDA_SOURCE_DIR ${CMAKE_CURRENT_SOURCE_DIR}/src) SET(CUDA_SOURCE_CLASS CudaDrudeKernelSources) SET(CUDA_KERNELS_CPP ${CMAKE_CURRENT_BINARY_DIR}/src/${CUDA_SOURCE_CLASS}.cpp) SET(CUDA_KERNELS_H ${CMAKE_CURRENT_BINARY_DIR}/src/${CUDA_SOURCE_CLASS}.h) SET(SOURCE_FILES ${SOURCE_FILES} ${CUDA_KERNELS_CPP} ${CUDA_KERNELS_H}) INCLUDE_DIRECTORIES(BEFORE ${CMAKE_CURRENT_BINARY_DIR}/src) # Create the library INCLUDE_DIRECTORIES(${CUDA_TOOLKIT_INCLUDE}) FILE(GLOB CUDA_KERNELS ${CUDA_SOURCE_DIR}/kernels/*.cu) ADD_CUSTOM_COMMAND(OUTPUT ${CUDA_KERNELS_CPP} ${CUDA_KERNELS_H} COMMAND ${CMAKE_COMMAND} ARGS -D CUDA_SOURCE_DIR=${CUDA_SOURCE_DIR} -D CUDA_KERNELS_CPP=${CUDA_KERNELS_CPP} -D CUDA_KERNELS_H=${CUDA_KERNELS_H} -D CUDA_SOURCE_CLASS=${CUDA_SOURCE_CLASS} -P ${CMAKE_SOURCE_DIR}/platforms/cuda/EncodeCUDAFiles.cmake DEPENDS ${CUDA_KERNELS} ) SET_SOURCE_FILES_PROPERTIES(${CUDA_KERNELS_CPP} ${CUDA_KERNELS_H} PROPERTIES GENERATED TRUE) ADD_LIBRARY(${SHARED_TARGET} SHARED ${SOURCE_FILES} ${SOURCE_INCLUDE_FILES} ${API_ABS_INCLUDE_FILES}) TARGET_LINK_LIBRARIES(${SHARED_TARGET} ${OPENMM_LIBRARY_NAME} ${PTHREADS_LIB}) TARGET_LINK_LIBRARIES(${SHARED_TARGET} ${OPENMM_LIBRARY_NAME}CUDA) TARGET_LINK_LIBRARIES(${SHARED_TARGET} ${SHARED_DRUDE_TARGET}) SET_TARGET_PROPERTIES(${SHARED_TARGET} PROPERTIES COMPILE_FLAGS "${EXTRA_COMPILE_FLAGS} -DOPENMM_BUILDING_SHARED_LIBRARY") IF (APPLE) SET_TARGET_PROPERTIES(${SHARED_TARGET} PROPERTIES LINK_FLAGS "${EXTRA_COMPILE_FLAGS} -F/Library/Frameworks -framework CUDA") ELSE (APPLE) SET_TARGET_PROPERTIES(${SHARED_TARGET} PROPERTIES LINK_FLAGS "${EXTRA_LINK_FLAGS}") ENDIF (APPLE) INSTALL(TARGETS ${SHARED_TARGET} DESTINATION ${CMAKE_INSTALL_PREFIX}/lib/plugins) # Ensure that links to the main CUDA library will be resolved. IF (APPLE) SET(CUDA_LIBRARY libOpenMMCUDA.dylib) INSTALL(CODE "EXECUTE_PROCESS(COMMAND install_name_tool -change ${CUDA_LIBRARY} @loader_path/${CUDA_LIBRARY} ${CMAKE_INSTALL_PREFIX}/lib/plugins/lib${SHARED_TARGET}.dylib)") ENDIF (APPLE) if(OPENMM_BUILD_CUDA_TESTS) SUBDIRS (tests) endif(OPENMM_BUILD_CUDA_TESTS)