Index: head/science/lammps/Makefile =================================================================== --- head/science/lammps/Makefile (revision 533698) +++ head/science/lammps/Makefile (revision 533699) @@ -1,92 +1,98 @@ # $FreeBSD$ PORTNAME= lammps PORTVERSION= ${GH_TAGNAME:C/(stable|patch)_([0-9]{1,2})([A-Z][a-z][a-z])([0-9]{4})/\4.\3.\2/S/Jan/01/S/Feb/02/S/Mar/03/S/Apr/04/S/May/05/S/Jun/06/S/Jul/07/S/Aug/08/S/Sep/09/S/Oct/10/S/Nov/11/S/Dec/12/} -PORTREVISION= 1 +PORTREVISION= 2 CATEGORIES= science MAINTAINER= yuri@FreeBSD.org COMMENT= Classical molecular dynamics code with a focus on materials modeling LICENSE= GPLv2 LICENSE_FILE= ${WRKSRC}/LICENSE BROKEN_i386= undefined reference to `__atomic_load' CONFLICTS_BUILD= ga mpich mpich2 # conflicts with include/error.h from ga, already fixed in the head LIB_DEPENDS= libfftw3.so:math/fftw3 USES= blaslapack:openblas cmake:noninja eigen:3 fortran localbase:ldflags shebangfix USE_GITHUB= yes GH_TAGNAME= patch_15Apr2020 USE_LDCONFIG= yes SHEBANG_GLOB= *.sh *.bash SHEBANG_FILES= lib/kokkos/bin/nvcc_wrapper CMAKE_ON= BUILD_SHARED_LIBS CMAKE_SOURCE_PATH= ${WRKSRC}/cmake CMAKE_ARGS= -DBLA_VENDOR:STRING="OpenBLAS" ${CMAKE_ARGS_${CHOSEN_COMPILER_TYPE}} CMAKE_ARGS_gcc= -DBUILD_OMP:BOOL=false # enable packages (for a complete list see STANDARD_PACKAGES in cmake/CMakeLists.txt) CMAKE_ON+= PKG_ASPHERE PKG_BODY PKG_CLASS2 PKG_COLLOID PKG_COMPRESS PKG_DIPOLE CMAKE_ON+= PKG_GRANULAR PKG_KSPACE PKG_MANYBODY PKG_MC PKG_MESSAGE PKG_MOLECULE PKG_PERI PKG_POEMS PKG_QEQ CMAKE_ON+= PKG_REPLICA PKG_RIGID PKG_SHOCK PKG_SPIN PKG_SNAP PKG_SRD # PKG_MISC is broken: https://github.com/lammps/lammps/issues/2057 # PKG_KIM is broken: https://github.com/lammps/lammps/issues/2059 -# Packages requiring extra downloades or dependencies: PKG_MSCG PKG_KOKKOS +# Packages requiring extra downloades or dependencies: PKG_MSCG -OPTIONS_DEFINE= JPEG PNG GZIP FFMPEG VORONOI LATTE +OPTIONS_DEFINE= JPEG PNG GZIP FFMPEG KOKKOS VORONOI LATTE OPTIONS_DEFINE_clang= OPENMP -OPTIONS_GROUP= PARALLEL -OPTIONS_GROUP_PARALLEL= MPI ${OPTIONS_DEFINE_${CHOSEN_COMPILER_TYPE}} -OPTIONS_DEFAULT= MPI JPEG PNG GZIP FFMPEG VORONOI LATTE ${OPTIONS_DEFAULT_${CHOSEN_COMPILER_TYPE}} +OPTIONS_GROUP= PARALLEL PACKAGES +OPTIONS_DEFAULT= MPI JPEG PNG GZIP FFMPEG KOKKOS VORONOI LATTE ${OPTIONS_DEFAULT_${CHOSEN_COMPILER_TYPE}} OPTIONS_DEFAULT_clang= OPENMP OPTIONS_SUB= yes PARALLEL_DESC= Enable parallelizations: +PACKAGES_DESC= Enable packages: +OPTIONS_GROUP_PARALLEL= MPI ${OPTIONS_DEFINE_${CHOSEN_COMPILER_TYPE}} +OPTIONS_GROUP_PACKAGES= KOKKOS VORONOI LATTE MPI_CMAKE_BOOL= BUILD_MPI PKG_MPIIO MPI_LIB_DEPENDS= libmpi.so:net/openmpi MPI_USES= compiler:c11 FFMPEG_BUILD_DEPENDS= ffmpeg:multimedia/ffmpeg FFMPEG_RUN_DEPENDS= ffmpeg:multimedia/ffmpeg JPEG_CMAKE_BOOL= WITH_JPEG JPEG_USES= jpeg PNG_CMAKE_BOOL= WITH_PNG PNG_LIB_DEPENDS= libpng.so:graphics/png GZIP_DESC= Enable GZIP support GZIP_CMAKE_BOOL= WITH_GZIP FFMPEG_CMAKE_BOOL= WITH_FFMPEG -VORONOI_DESC= Use voro++, Voronoi tessellation package +KOKKOS_DESC= kokkos package based on the libkokkos library +KOKKOS_CMAKE_BOOL= PKG_KOKKOS EXTERNAL_KOKKOS +KOKKOS_LIB_DEPENDS= libkokkoscore.so:devel/kokkos + +VORONOI_DESC= voro++, Voronoi tessellation package VORONOI_CMAKE_BOOL= PKG_VORONOI VORONOI_LIB_DEPENDS= libvoro++.so:science/voro++ -LATTE_DESC= Use LATTE package +LATTE_DESC= latte package based on the liblatte library LATTE_CMAKE_BOOL= PKG_LATTE LATTE_LIB_DEPENDS= liblatte.so:science/latte PORTSCOUT= ignore:1 # due to a special version tagging scheme that this project uses portscout fails to find new versions, watching their GitHub release page instead .include .if ${PORT_OPTIONS:MOPENMP} CMAKE_ARGS+= -DBUILD_OMP:BOOL=true .endif post-patch: @${REINPLACE_CMD} 's|SHELL = /bin/bash|SHELL = ${LOCALBASE}/bin/bash|' ${WRKSRC}/src/Makefile post-patch-FFMPEG-off: @${REINPLACE_CMD} 's|find_program(FFMPEG_EXECUTABLE|#&|' ${WRKSRC}/cmake/CMakeLists.txt post-install: @${RM} -r ${STAGEDIR}${PREFIX}/lib/python* .include