added USER-ATC (c6442475) · Commits · 郑智淋 / lammps

cmake/CMakeLists.txt

+11 −5

Original line number	Diff line number	Diff line
		@@ -43,7 +43,7 @@ option(CMAKE_VERBOSE_MAKEFILE "Verbose makefile" OFF)
		option(ENABLE_ALL "Build all packages" OFF)
		set(PACKAGES ASPHERE BODY CLASS2 COLLOID COMPRESS CORESHELL DIPOLE GRANULAR
		KSPACE MANYBODY MC MEAM MISC MOLECULE MSCG MPIIO PERI POEMS PYTHON QEQ
		REAX REPLICA RIGID SHOCK SNAP SRD VORONOI)
		REAX REPLICA RIGID SHOCK SNAP SRD VORONOI USER-ATC)
		foreach(PKG ${PACKAGES})
		option(ENABLE_${PKG} "Build ${PKG} Package" ${ENABLE_ALL})
		endforeach()
		@@ -55,12 +55,13 @@ endforeach()

		macro(pkg_depends PKG1 PKG2)
		if(ENABLE_${PKG1} AND NOT ENABLE_${PKG2})
		message(FATAL_ERROR "${PKG1} package needed to LAMMPS to be build with ${PKG2}")
		message(FATAL_ERROR "${PKG1} package needs LAMMPS to be build with ${PKG2}")
		endif()
		endmacro()

		pkg_depends(MPIIO MPI)
		pkg_depends(QEQ MANYBODY)
		pkg_depends(USER-ATC MANYBODY)

		if(ENABLE_KSPACE)
		find_package(FFTW3)
		@@ -86,6 +87,11 @@ if(ENABLE_KOKKOS)
		list(APPEND LAMMPS_LINK_LIBS kokkos)
		endif()

		if(ENABLE_MSCG OR ENABLE_USER-ATC)
		find_package(LAPACK REQUIRED)
		list(APPEND LAMMPS_LINK_LIBS ${LAPACK_LIBRARIES})
		endif()

		if(ENABLE_PYTHON)
		find_package(PythonLibs REQUIRED)
		add_definitions(-DLMP_PYTHON)
		@@ -195,8 +201,9 @@ if(ENABLE_USER_OMP OR ENABLE_KOKKOS)
		set (CMAKE_CXX_FLAGS "${CMAKE_CXX_FLAGS} ${OpenMP_CXX_FLAGS}")
		endif()

		foreach(SIMPLE_LIB REAX MEAM POEMS)
		foreach(SIMPLE_LIB REAX MEAM POEMS USER-ATC)
		if(ENABLE_${SIMPLE_LIB})
		string(REGEX REPLACE "^USER-" "" SIMPLE_LIB "${SIMPLE_LIB}")
		string(TOLOWER "${SIMPLE_LIB}" INC_DIR)
		file(GLOB ${SIMPLE_LIB}_SOURCES ${LAMMPS_LIB_SOURCE_DIR}/${INC_DIR}/*.F
		${LAMMPS_LIB_SOURCE_DIR}/${INC_DIR}/.c ${LAMMPS_LIB_SOURCE_DIR}/${INC_DIR}/.cpp)
		@@ -207,7 +214,6 @@ endforeach()

		if(ENABLE_MSCG)
		find_package(GSL REQUIRED)
		find_package(LAPACK REQUIRED)
		set(LAMMPS_LIB_MSCG_BIN_DIR ${LAMMPS_LIB_BINARY_DIR}/mscg)
		set(MSCG_TARBALL ${LAMMPS_LIB_MSCG_BIN_DIR}/MS-CG-master.zip)
		set(LAMMPS_LIB_MSCG_BIN_DIR ${LAMMPS_LIB_MSCG_BIN_DIR}/MSCG-release-master/src)
		@@ -229,7 +235,7 @@ if(ENABLE_MSCG)
		DIMENSION=3 _exclude_gromacs=1)
		endforeach()
		include_directories(${LAMMPS_LIB_MSCG_BIN_DIR} ${GSL_INCLUDE_DIRS})
		list(APPEND LAMMPS_LINK_LIBS ${GSL_LIBRARIES} ${LAPACK_LIBRARIES})
		list(APPEND LAMMPS_LINK_LIBS ${GSL_LIBRARIES})
		endif()

		######################################################################

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