diff --git a/science/py-optking/Makefile b/science/py-optking/Makefile index dcae07ab8245..209779934980 100644 --- a/science/py-optking/Makefile +++ b/science/py-optking/Makefile @@ -1,28 +1,27 @@ PORTNAME= optking -DISTVERSION= 0.3.0 -PORTREVISION= 4 +DISTVERSION= 0.5.0 CATEGORIES= science python # chemistry PKGNAMEPREFIX= ${PYTHON_PKGNAMEPREFIX} MAINTAINER= yuri@FreeBSD.org COMMENT= Python version of the PSI4 geometry optimization program by R.A. King WWW= https://github.com/psi-rking/optking LICENSE= BSD3CLAUSE LICENSE_FILE= ${WRKSRC}/LICENSE RUN_DEPENDS= ${PYTHON_PKGNAMEPREFIX}msgpack>=1.0:devel/py-msgpack@${PY_FLAVOR} \ ${PYTHON_PKGNAMEPREFIX}numpy1>=1.16:math/py-numpy1@${PY_FLAVOR} \ ${PYTHON_PKGNAMEPREFIX}qcelemental>=0.20.0:science/py-qcelemental@${PY_FLAVOR} \ ${PYTHON_PKGNAMEPREFIX}qcengine>=0.20.0:science/py-qcengine@${PY_FLAVOR} TEST_DEPENDS= dftd3:science/dftd3 USES= python USE_PYTHON= distutils autoplist pytest # some tests fail USE_GITHUB= yes GH_ACCOUNT= psi-rking NO_ARCH= yes .include diff --git a/science/py-optking/distinfo b/science/py-optking/distinfo index dda2c9278286..f425e69cdd4c 100644 --- a/science/py-optking/distinfo +++ b/science/py-optking/distinfo @@ -1,3 +1,3 @@ -TIMESTAMP = 1726459201 -SHA256 (psi-rking-optking-0.3.0_GH0.tar.gz) = 05aa6079f4cebef9fbe8cc36c7315123afeb53fb3feed959f98d963060e1085c -SIZE (psi-rking-optking-0.3.0_GH0.tar.gz) = 290726 +TIMESTAMP = 1776737874 +SHA256 (psi-rking-optking-0.5.0_GH0.tar.gz) = 92cd81b5824d5570c054dc007a1f6e346f26546735e64fc5e814316ba31e62e9 +SIZE (psi-rking-optking-0.5.0_GH0.tar.gz) = 1017350