blob: 036beeae13b32531aed6c9e951e24e8b80f2f246 (
plain) (
tree)
|
|
PORTNAME= openmolcas
DISTVERSION= 22.02
CATEGORIES= science # chemistry
MAINTAINER= yuri@FreeBSD.org
COMMENT= Quantum chemistry software package
LICENSE= LGPL21
LICENSE_FILE= ${WRKSRC}/LICENSE
BROKEN_i386= build breaks: Symbol 'maxfilesize' at (1) has no IMPLICIT type; did you mean 'mxfile'?
BUILD_DEPENDS= ${PYTHON_PKGNAMEPREFIX}pyparsing>0:devel/py-pyparsing@${PY_FLAVOR}
LIB_DEPENDS= libhdf5.so:science/hdf5 \
libsz.so:science/szip \
libxc.so:science/libxc
USES= cmake fortran python shebangfix
USE_GCC= yes # see https://gitlab.com/Molcas/OpenMolcas/-/issues/351
USE_GITLAB= yes
GL_ACCOUNT= Molcas
GL_PROJECT= OpenMolcas
GL_COMMIT= f8df69cf87b241a15ebc82d72a8f9a031a385dd4
USE_GITHUB= nodefault
GH_TUPLE= Reference-LAPACK:lapack:aa631b4b:lapack/External/lapack \
libwfa:libwfa:bbe3392a:libwfa/External/libwfa
SHEBANG_FILES= sbin/help_doc sbin/help_func sbin/help_basis sbin/setup sbin/verify sbin/version
CMAKE_ARGS= -DEXTERNAL_LIBXC:STRING=${LOCALBASE} \
-DFREEBSD_PYTHON_VER:STRING=${PYTHON_VER}
#CMAKE_ON= # for EFPLIB, MSYM see https://gitlab.com/Molcas/OpenMolcas/-/issues/350, for WFA - hdf5 needs updating
CMAKE_OFF= BUILD_TESTING
CMAKE_INSTALL_PREFIX= ${DATADIR} # installed into DATADIR because it doesn't respect UNIX file path conventions, see https://gitlab.com/Molcas/OpenMolcas/-/issues/352
BINARY_ALIAS= cpp=${CPP} # cpp is called from cmake scripts
post-install:
# remove unused static libraries, see https://gitlab.com/Molcas/OpenMolcas/-/issues/354
@${RM} -r ${STAGEDIR}${CMAKE_INSTALL_PREFIX}/lib
# remove unnecessary fines
@${RM} ${STAGEDIR}${CMAKE_INSTALL_PREFIX}/CONTRIBUTORS.md
@${RM} ${STAGEDIR}${CMAKE_INSTALL_PREFIX}/LICENSE
# remove empty doc directory
@${RMDIR} ${STAGEDIR}${DATADIR}/doc
.include <bsd.port.mk>
|
