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| Original file line number | Diff line number | Diff line change |
|---|---|---|
| @@ -1,50 +1,62 @@ | ||
| # PACE library support for ML-PACE package | ||
| find_package(pace QUIET) | ||
|
|
||
| # set policy to silence warnings about timestamps of downloaded files. review occasionally if it may be set to NEW | ||
| if(POLICY CMP0135) | ||
| cmake_policy(SET CMP0135 OLD) | ||
| endif() | ||
| if(pace_FOUND) | ||
| find_package(pace) | ||
| target_link_libraries(lammps PRIVATE pace::pace) | ||
| else() | ||
| # set policy to silence warnings about timestamps of downloaded files. review occasionally if it may be set to NEW | ||
| if(POLICY CMP0135) | ||
| cmake_policy(SET CMP0135 OLD) | ||
| endif() | ||
|
|
||
| set(PACELIB_URL "https://github.com/ICAMS/lammps-user-pace/archive/refs/tags/v.2023.11.25.fix.tar.gz" CACHE STRING "URL for PACE evaluator library sources") | ||
| set(PACELIB_MD5 "b45de9a633f42ed65422567e3ce56f9f" CACHE STRING "MD5 checksum of PACE evaluator library tarball") | ||
| mark_as_advanced(PACELIB_URL) | ||
| mark_as_advanced(PACELIB_MD5) | ||
| GetFallbackURL(PACELIB_URL PACELIB_FALLBACK) | ||
| set(PACELIB_URL "https://github.com/ICAMS/lammps-user-pace/archive/refs/tags/v.2023.11.25.fix2.tar.gz" CACHE STRING "URL for PACE evaluator library sources") | ||
| set(PACELIB_MD5 "a53bd87cfee8b07d9f44bc17aad69c3f" CACHE STRING "MD5 checksum of PACE evaluator library tarball") | ||
| mark_as_advanced(PACELIB_URL) | ||
| mark_as_advanced(PACELIB_MD5) | ||
| GetFallbackURL(PACELIB_URL PACELIB_FALLBACK) | ||
|
|
||
| # LOCAL_ML-PACE points to top-level dir with local lammps-user-pace repo, | ||
| # to make it easier to check local build without going through the public github releases | ||
| if(LOCAL_ML-PACE) | ||
| set(lib-pace "${LOCAL_ML-PACE}") | ||
| else() | ||
| # download library sources to build folder | ||
| if(EXISTS ${CMAKE_BINARY_DIR}/libpace.tar.gz) | ||
| file(MD5 ${CMAKE_BINARY_DIR}/libpace.tar.gz DL_MD5) | ||
| endif() | ||
| if(NOT "${DL_MD5}" STREQUAL "${PACELIB_MD5}") | ||
| message(STATUS "Downloading ${PACELIB_URL}") | ||
| file(DOWNLOAD ${PACELIB_URL} ${CMAKE_BINARY_DIR}/libpace.tar.gz STATUS DL_STATUS SHOW_PROGRESS) | ||
| file(MD5 ${CMAKE_BINARY_DIR}/libpace.tar.gz DL_MD5) | ||
| if((NOT DL_STATUS EQUAL 0) OR (NOT "${DL_MD5}" STREQUAL "${PACELIB_MD5}")) | ||
| message(WARNING "Download from primary URL ${PACELIB_URL} failed\nTrying fallback URL ${PACELIB_FALLBACK}") | ||
| file(DOWNLOAD ${PACELIB_FALLBACK} ${CMAKE_BINARY_DIR}/libpace.tar.gz EXPECTED_HASH MD5=${PACELIB_MD5} SHOW_PROGRESS) | ||
| # LOCAL_ML-PACE points to top-level dir with local lammps-user-pace repo, | ||
| # to make it easier to check local build without going through the public github releases | ||
| if(LOCAL_ML-PACE) | ||
| set(lib-pace "${LOCAL_ML-PACE}") | ||
| else() | ||
| # download library sources to build folder | ||
| if(EXISTS ${CMAKE_BINARY_DIR}/libpace.tar.gz) | ||
| file(MD5 ${CMAKE_BINARY_DIR}/libpace.tar.gz DL_MD5) | ||
| endif() | ||
| if(NOT "${DL_MD5}" STREQUAL "${PACELIB_MD5}") | ||
| message(STATUS "Downloading ${PACELIB_URL}") | ||
| file(DOWNLOAD ${PACELIB_URL} ${CMAKE_BINARY_DIR}/libpace.tar.gz STATUS DL_STATUS SHOW_PROGRESS) | ||
| file(MD5 ${CMAKE_BINARY_DIR}/libpace.tar.gz DL_MD5) | ||
| if((NOT DL_STATUS EQUAL 0) OR (NOT "${DL_MD5}" STREQUAL "${PACELIB_MD5}")) | ||
| message(WARNING "Download from primary URL ${PACELIB_URL} failed\nTrying fallback URL ${PACELIB_FALLBACK}") | ||
| file(DOWNLOAD ${PACELIB_FALLBACK} ${CMAKE_BINARY_DIR}/libpace.tar.gz EXPECTED_HASH MD5=${PACELIB_MD5} SHOW_PROGRESS) | ||
| endif() | ||
| else() | ||
| message(STATUS "Using already downloaded archive ${CMAKE_BINARY_DIR}/libpace.tar.gz") | ||
| endif() | ||
|
|
||
|
|
||
| # uncompress downloaded sources | ||
| execute_process( | ||
| COMMAND ${CMAKE_COMMAND} -E remove_directory lammps-user-pace* | ||
| COMMAND ${CMAKE_COMMAND} -E tar xzf libpace.tar.gz | ||
| WORKING_DIRECTORY ${CMAKE_BINARY_DIR} | ||
| ) | ||
| get_newest_file(${CMAKE_BINARY_DIR}/lammps-user-pace-* lib-pace) | ||
| endif() | ||
| else() | ||
| message(STATUS "Using already downloaded archive ${CMAKE_BINARY_DIR}/libpace.tar.gz") | ||
| endif() | ||
|
|
||
|
|
||
| # uncompress downloaded sources | ||
| execute_process( | ||
| COMMAND ${CMAKE_COMMAND} -E remove_directory lammps-user-pace* | ||
| COMMAND ${CMAKE_COMMAND} -E tar xzf libpace.tar.gz | ||
| WORKING_DIRECTORY ${CMAKE_BINARY_DIR} | ||
| ) | ||
| get_newest_file(${CMAKE_BINARY_DIR}/lammps-user-pace-* lib-pace) | ||
| endif() | ||
|
|
||
| add_subdirectory(${lib-pace} build-pace) | ||
| set_target_properties(pace PROPERTIES CXX_EXTENSIONS ON OUTPUT_NAME lammps_pace${LAMMPS_MACHINE}) | ||
| # some preinstalled yaml-cpp versions don't provide a namespaced target | ||
| find_package(yaml-cpp QUIET) | ||
| if(TARGET yaml-cpp AND NOT TARGET yaml-cpp::yaml-cpp) | ||
| add_library(yaml-cpp::yaml-cpp ALIAS yaml-cpp) | ||
| endif() | ||
|
|
||
| if(CMAKE_PROJECT_NAME STREQUAL "lammps") | ||
| target_link_libraries(lammps PRIVATE pace) | ||
| add_subdirectory(${lib-pace} build-pace) | ||
| set_target_properties(pace PROPERTIES CXX_EXTENSIONS ON OUTPUT_NAME lammps_pace${LAMMPS_MACHINE}) | ||
|
|
||
| if(CMAKE_PROJECT_NAME STREQUAL "lammps") | ||
| target_link_libraries(lammps PRIVATE pace) | ||
| endif() | ||
| endif() |
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