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PORTNAME= gpaw
DISTVERSION= 21.1.0
CATEGORIES= science python
MASTER_SITES= CHEESESHOP
PKGNAMEPREFIX= ${PYTHON_PKGNAMEPREFIX}
MAINTAINER= yuri@FreeBSD.org
COMMENT= DFT and beyond within the projector-augmented wave method in chemistry
LICENSE= GPLv3+
LICENSE_FILE= ${WRKSRC}/LICENSE
BUILD_DEPENDS= ${PYNUMPY}
LIB_DEPENDS= libblas.so:math/blas \
libmpich.so:net/mpich \
libopenblas.so:math/openblas \
libxc.so:science/libxc
RUN_DEPENDS= ${PYTHON_PKGNAMEPREFIX}ase>0:science/py-ase@${PY_FLAVOR} \
${PYTHON_PKGNAMEPREFIX}matplotlib>0:math/py-matplotlib@${PY_FLAVOR} \
${PYNUMPY}
USES= gettext-runtime localbase python:3.5+ shebangfix
USE_PYTHON= distutils concurrent autoplist
SHEBANG_FILES= tools/*
post-patch:
@${REINPLACE_CMD} "s|'/usr/local/|'${LOCALBASE}/|" ${WRKSRC}/gpaw/__init__.py
post-install:
@${STRIP_CMD} ${STAGEDIR}${PYTHONPREFIX_SITELIBDIR}/_gpaw*.so
.include <bsd.port.mk>
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