diff --git a/science/py-pyscf/Makefile b/science/py-pyscf/Makefile index 96300c4229c7..e41b1072f57d 100644 --- a/science/py-pyscf/Makefile +++ b/science/py-pyscf/Makefile @@ -1,45 +1,46 @@ PORTNAME= pyscf DISTVERSIONPREFIX= v -DISTVERSION= 2.3.0 +DISTVERSION= 2.4.0 CATEGORIES= science python PKGNAMEPREFIX= ${PYTHON_PKGNAMEPREFIX} MAINTAINER= yuri@FreeBSD.org COMMENT= Python module for quantum chemistry WWW= https://pyscf.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} \ + ${PYTHON_PKGNAMEPREFIX}wheel>0:devel/py-wheel@${PY_FLAVOR} \ 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 # 3818 warnings, 57 errors in tests, see https://github.com/pyscf/pyscf/issues/1536 USE_GITHUB= yes POST_PLIST= fix-plist TEST_ENV= ${MAKE_ENV} PYTHONPATH=${STAGEDIR}${PYTHONPREFIX_SITELIBDIR} TEST_WRKSRC= ${WRKSRC}/pyscf TEST_ARGS= -c ${WRKSRC}/setup.cfg post-install: @${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 diff --git a/science/py-pyscf/distinfo b/science/py-pyscf/distinfo index 987c2a386266..37c7bc6233f8 100644 --- a/science/py-pyscf/distinfo +++ b/science/py-pyscf/distinfo @@ -1,3 +1,3 @@ -TIMESTAMP = 1688955605 -SHA256 (pyscf-pyscf-v2.3.0_GH0.tar.gz) = 884065031ae6591dbf75cd2e05336bb43363cf44eeef3443de4adefe0124ee36 -SIZE (pyscf-pyscf-v2.3.0_GH0.tar.gz) = 11030928 +TIMESTAMP = 1697776694 +SHA256 (pyscf-pyscf-v2.4.0_GH0.tar.gz) = cc76440b9a7bf6a4969559b61eceb67c25760d211e6f59fc540209b1ea359d8d +SIZE (pyscf-pyscf-v2.4.0_GH0.tar.gz) = 11071814