diff --git a/science/py-moltemplate/Makefile b/science/py-moltemplate/Makefile index 06656661f898..dd8693aca609 100644 --- a/science/py-moltemplate/Makefile +++ b/science/py-moltemplate/Makefile @@ -1,42 +1,42 @@ PORTNAME= moltemplate DISTVERSIONPREFIX= v -DISTVERSION= 2.20.14 +DISTVERSION= 2.20.15 CATEGORIES= science python PKGNAMEPREFIX= ${PYTHON_PKGNAMEPREFIX} MAINTAINER= yuri@FreeBSD.org COMMENT= Tool to prepare simulations of molecules, complex molecular assemblies WWW= https://www.moltemplate.org/ LICENSE= MIT BUILD_DEPENDS= ${PYTHON_PKGNAMEPREFIX}pytest-runner>0:devel/py-pytest-runner@${PY_FLAVOR} RUN_DEPENDS= ${PYNUMPY} \ bash:shells/bash TEST_DEPENDS= shunit2>0:devel/shunit2 USES= python:3.6+ shebangfix USE_PYTHON= distutils concurrent autoplist USE_GITHUB= yes GH_ACCOUNT= jewettaij SHEBANG_FILES= moltemplate/scripts/molc.sh NO_ARCH= yes BINARY_ALIAS= python3=${PYTHON_CMD} TEST_ENV= ${MAKE_ENV} PYTHONPATH=${STAGEDIR}${PYTHONPREFIX_SITELIBDIR} PATH=${STAGEDIR}${LOCALBASE}/bin:${PATH} do-test: # testsuite instructions: https://github.com/jewettaij/moltemplate/issues/65#issuecomment-1022740972 # 1 test fails, see https://github.com/jewettaij/moltemplate/issues/65 @cd ${WRKSRC} && \ ([ -e shunit2 ] || (${MKDIR} shunit2 && ${LN} -s ${LOCALBASE}/bin/shunit2 shunit2/shunit2)) && \ ${SETENV} ${TEST_ENV} bash tests/test_read_coords_pdb.sh && \ ${SETENV} ${TEST_ENV} bash tests/test_ltemplify.sh && \ ${SETENV} ${TEST_ENV} bash tests/test_oplsaa.sh && \ ${SETENV} ${TEST_ENV} bash tests/test_compass.sh && \ ${SETENV} ${TEST_ENV} python3 tests/test_genpoly_lt.py .include diff --git a/science/py-moltemplate/distinfo b/science/py-moltemplate/distinfo index e2d07cc5f1bb..ace387fcd020 100644 --- a/science/py-moltemplate/distinfo +++ b/science/py-moltemplate/distinfo @@ -1,3 +1,3 @@ -TIMESTAMP = 1664206301 -SHA256 (jewettaij-moltemplate-v2.20.14_GH0.tar.gz) = 3f8f97615144e1cd17ae4ec4047bff9694c89e78ce3991972a379af58746ffd8 -SIZE (jewettaij-moltemplate-v2.20.14_GH0.tar.gz) = 8551446 +TIMESTAMP = 1667880840 +SHA256 (jewettaij-moltemplate-v2.20.15_GH0.tar.gz) = eb34f77819c42e4078fa1dcf367668234e801b1f1de0211810760565e931993b +SIZE (jewettaij-moltemplate-v2.20.15_GH0.tar.gz) = 8552730