| Server IP : 82.208.35.60 / Your IP : 216.73.216.89 Web Server : Apache/2.4.55 (FreeBSD) OpenSSL/1.1.1q-freebsd PHP/7.3.31 System : FreeBSD server7.d2m.cz 12.4-RELEASE-p9 FreeBSD 12.4-RELEASE-p9 GENERIC amd64 User : studiokobylisy_cz ( 1008) PHP Version : 7.3.31 Disable Function : NONE MySQL : OFF | cURL : ON | WGET : OFF | Perl : OFF | Python : OFF | Sudo : OFF | Pkexec : OFF Directory : /usr/ports/science/py-pyscf/ |
Upload File : |
PORTNAME= pyscf
DISTVERSIONPREFIX= v
DISTVERSION= 2.1.0
CATEGORIES= science python
PKGNAMEPREFIX= ${PYTHON_PKGNAMEPREFIX}
MAINTAINER= yuri@FreeBSD.org
COMMENT= Python module for quantum chemistry
WWW= https://www.pymol.org/
LICENSE= BSD2CLAUSE
LICENSE_FILE= ${WRKSRC}/LICENSE
PY_DEPENDS= ${PYNUMPY} \
${PYTHON_PKGNAMEPREFIX}scipy>0:science/py-scipy@${PY_FLAVOR} \
${PYTHON_PKGNAMEPREFIX}h5py>=2.7:science/py-h5py@${PY_FLAVOR}
BUILD_DEPENDS= ${PY_DEPENDS} \
cmake:devel/cmake-core \
gmake:devel/gmake
LIB_DEPENDS= libcint.so:science/libcint \
libxc.so:science/libxc \
libxcfun.so:science/xcfun
RUN_DEPENDS= ${PY_DEPENDS}
USES= fortran blaslapack:openblas compiler:c++11-lang python
USE_PYTHON= distutils autoplist pytest
USE_GITHUB= yes
POST_PLIST= fix-plist
TEST_ENV= ${MAKE_ENV} PYTHONPATH=${STAGEDIR}${PYTHONPREFIX_SITELIBDIR}
post-install:
@${STRIP_CMD} ${STAGEDIR}${PYTHON_SITELIBDIR}/pyscf/lib/lib*.so
fix-plist:
@${REINPLACE_CMD} -e 's|.*pyscf_lib_placeholder.so$$||' ${TMPPLIST}
post-test:
@${ECHO} "==> simple test ..."
@${SETENV} ${TEST_ENV} ${PYTHON_CMD} ${FILESDIR}/test.py
.include <bsd.port.mk>