diff --git a/science/dirac/Makefile b/science/dirac/Makefile index 627ddca9e8d2..c65e3d3f1179 100644 --- a/science/dirac/Makefile +++ b/science/dirac/Makefile @@ -1,41 +1,43 @@ PORTNAME= dirac DISTVERSION= 22.0 CATEGORIES= science # chemistry MASTER_SITES= https://zenodo.org/record/6010450/files/ PKGNAMESUFFIX= -quantum-chemistry-software DISTNAME= ${PORTNAME:tu}-${DISTVERSION}-Source MAINTAINER= yuri@FreeBSD.org COMMENT= Program for atomic & molecular relativistic all-electron calculations LICENSE= LGPL21 LICENSE_FILE= ${WRKSRC}/LICENSE BUILD_DEPENDS= gmake:devel/gmake LIB_DEPENDS= libblas.so:math/blas \ libhdf5.so:science/hdf5 \ liblapack.so:math/lapack USES= cmake:noninja,testing fortran python shebangfix #USE_GITLAB= yes #GL_COMMIT= 37b755410d9fdcd9b5e7bba6e43ceb7d5c7b9dae SHEBANG_FILES= pam.in \ utils/process_schema.py \ utils/dirac_data.py CMAKE_OFF= ENABLE_EXATENSOR \ ENABLE_PCMSOLVER # PCMSolver integration is broken, see https://gitlab.com/dirac/dirac/-/issues/33 and https://gitlab.com/dirac/dirac/-/issues/34 CMAKE_ARGS= -DMKL_FLAG=off CFLAGS+= -DSYS_LINUX # see https://gitlab.com/dirac/dirac/-/issues/32 CXXFLAGS+= -DSYS_LINUX FFLAGS+= -DSYS_LINUX LDFLAGS+= -llapack -lblas BINARY_ALIAS= make=${GMAKE} \ python=${PYTHON_CMD} \ python3=${PYTHON_CMD} +# 2 tests are known to fail, see https://gitlab.com/dirac/dirac/-/issues/35 + .include