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# $FreeBSD$
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/}
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 # conflicts with include/error.h, already fixed in the head
USES= blaslapack:openblas cmake:noninja eigen:3 fortran shebangfix
USE_GITHUB= yes
GH_TAGNAME= patch_30Apr2019
SHEBANG_GLOB= *.sh *.bash
SHEBANG_FILES= lib/kokkos/bin/nvcc_wrapper
CMAKE_SOURCE_PATH= ${WRKSRC}/cmake
CMAKE_ARGS= -DBLA_VENDOR:STRING="OpenBLAS"
OPTIONS_DEFINE= JPEG PNG GZIP FFMPEG VORONOI LATTE
OPTIONS_GROUP= PARALLEL
OPTIONS_GROUP_PARALLEL= MPI OPENMP
OPTIONS_DEFAULT= MPI OPENMP JPEG PNG GZIP FFMPEG VORONOI LATTE
PARALLEL_DESC= Enable parallelizations:
MPI_CMAKE_BOOL= BUILD_MPI
MPI_LIB_DEPENDS= libmpi.so:net/openmpi
OPENMP_CMAKE_BOOL= BUILD_OMP
OPENMP_LIB_DEPENDS= libomp.so:devel/openmp
FFMPEG_BUILD_DEPENDS= ffmpeg:multimedia/ffmpeg
FFMPEG_RUN_DEPENDS= ffmpeg:multimedia/ffmpeg
JPEG_CMAKE_BOOL= WITH_JPEG
JPEG_USES= jpeg
PNG_CMAKE_BOOL= WITH_PNG
PNG_LIB_DEPENDS= libpng16.so:graphics/png
GZIP_CMAKE_BOOL= WITH_GZIP
FFMPEG_CMAKE_BOOL= WITH_FFMPEG
VORONOI_DESC= Use voro++, Voronoi tessellation package
VORONOI_CMAKE_BOOL= PKG_VORONOI
VORONOI_LIB_DEPENDS= libvoro++.so:science/voro++
LATTE_DESC= Use LATTE package
LATTE_CMAKE_BOOL= PKG_LATTE
LATTE_LIB_DEPENDS= liblatte.so:science/latte
# use clang from ports because cmake can't find OpenMP with base clang, see https://bugs.freebsd.org/bugzilla/show_bug.cgi?id=223678
BUILD_DEPENDS+= clang${LLVM_DEFAULT}:devel/llvm${LLVM_DEFAULT}
CPP= clang-cpp${LLVM_DEFAULT}
CC= clang${LLVM_DEFAULT}
CXX= clang++${LLVM_DEFAULT}
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
.include <bsd.port.mk>
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