diff --git a/science/libcint/Makefile b/science/libcint/Makefile index fe680ba58539..fe8795e2cfec 100644 --- a/science/libcint/Makefile +++ b/science/libcint/Makefile @@ -1,41 +1,40 @@ PORTNAME= libcint DISTVERSIONPREFIX= v -DISTVERSION= 5.4.0 +DISTVERSION= 6.1.0 CATEGORIES= science MAINTAINER= yuri@FreeBSD.org COMMENT= General GTO integrals for quantum chemistry WWW= https://github.com/sunqm/libcint LICENSE= BSD2CLAUSE LICENSE_FILE= ${WRKSRC}/LICENSE -LIB_DEPENDS= libopenblas.so:math/openblas TEST_DEPENDS= ${PYNUMPY} \ ${PYTHON_PKGNAMEPREFIX}pyscf>0:science/py-pyscf@${PY_FLAVOR} USES= cmake blaslapack:openblas python:test USE_LDCONFIG= yes USE_GITHUB= yes GH_ACCOUNT= sunqm PLIST_FILES= include/cint.h \ include/cint_funcs.h \ lib/libcint.so \ lib/libcint.so.${PORTVERSION:R:R} \ lib/libcint.so.${PORTVERSION} post-patch: - @${REINPLACE_CMD} -e "s|numpy\\.ctypeslib\\.load_library('libcint', .*$$|numpy.ctypeslib.load_library('libcint', '${BUILD_WRKSRC}')|" \ - ${WRKSRC}/testsuite/test_cint4c1e.py \ - ${WRKSRC}/testsuite/test_cint.py \ + @${REINPLACE_CMD} -e "s|\\.\\./\\.\\./build/libcint\\.so|${BUILD_WRKSRC}/libcint.so|" \ ${WRKSRC}/testsuite/test_3c2e.py + @${REINPLACE_CMD} -e "s|os\\.path\\.abspath(os\\.path\\.join(__file__, '\\.\\./\\.\\./build/libcint\\.so'))|'${BUILD_WRKSRC}/libcint.so'|" \ + ${WRKSRC}/testsuite/test_cint.py do-test: # needs science/py-pyscf, pending https://github.com/pyscf/pyscf/issues/935 @cd ${BUILD_WRKSRC} && \ ${SETENV} ${CONFIGURE_ENV} ${CMAKE_BIN} ${CMAKE_ARGS} -DENABLE_TEST:BOOL=ON ${CMAKE_SOURCE_PATH} && \ ${SETENV} ${MAKE_ENV} ${MAKE_CMD} ${MAKE_ARGS} ${ALL_TARGET} && \ ${SETENV} ${MAKE_ENV} ${MAKE_CMD} ${MAKE_ARGS} test .include diff --git a/science/libcint/distinfo b/science/libcint/distinfo index 45c123c18749..91c0bdd7288a 100644 --- a/science/libcint/distinfo +++ b/science/libcint/distinfo @@ -1,3 +1,3 @@ -TIMESTAMP = 1688537374 -SHA256 (sunqm-libcint-v5.4.0_GH0.tar.gz) = 42a8f2e9244e4575437e426e32cd1e60ef9559971c42a41f860c870efc745d99 -SIZE (sunqm-libcint-v5.4.0_GH0.tar.gz) = 43038690 +TIMESTAMP = 1699782027 +SHA256 (sunqm-libcint-v6.1.0_GH0.tar.gz) = 9fc5fbf5397ee980941ab4bc4398547d7e5eaa78153819327816dc6a5b000bf0 +SIZE (sunqm-libcint-v6.1.0_GH0.tar.gz) = 50859482