From d736f61a46b378098f52b06f16171620cd6b2618 Mon Sep 17 00:00:00 2001 From: Yuri Victorovich Date: Fri, 24 Jan 2025 23:27:12 -0800 Subject: [PATCH] =?UTF-8?q?science/py-geometric:=20update=201.0=20?= =?UTF-8?q?=E2=86=92=201.1?= MIME-Version: 1.0 Content-Type: text/plain; charset=UTF-8 Content-Transfer-Encoding: 8bit Reported by: portscout --- science/py-geometric/Makefile | 11 +++++++---- science/py-geometric/distinfo | 6 +++--- 2 files changed, 10 insertions(+), 7 deletions(-) diff --git a/science/py-geometric/Makefile b/science/py-geometric/Makefile index aa7bb5ef8457..93e9176abb24 100644 --- a/science/py-geometric/Makefile +++ b/science/py-geometric/Makefile @@ -1,24 +1,27 @@ PORTNAME= geometric -DISTVERSION= 1.0 -PORTREVISION= 1 +DISTVERSION= 1.1 CATEGORIES= science python # chemistry MASTER_SITES= PYPI PKGNAMEPREFIX= ${PYTHON_PKGNAMEPREFIX} MAINTAINER= yuri@FreeBSD.org COMMENT= Geometry optimization for quantum chemistry -WWW= https://github.com/leeping/geomeTRIC +WWW= https://geometric.readthedocs.io/en/latest/ \ + https://github.com/leeping/geomeTRIC LICENSE= BSD3CLAUSE RUN_DEPENDS= ${PYNUMPY} \ ${PYTHON_PKGNAMEPREFIX}networkx>0:math/py-networkx@${PY_FLAVOR} \ + ${PYTHON_PKGNAMEPREFIX}scipy>0:science/py-scipy@${PY_FLAVOR} \ ${PYTHON_PKGNAMEPREFIX}six>0:devel/py-six@${PY_FLAVOR} TEST_DEPENDS= ${PYTHON_PKGNAMEPREFIX}ase>0:science/py-ase@${PY_FLAVOR} -USES= python +USES= python shebangfix USE_PYTHON= distutils concurrent autoplist pytest # some tests fail because of missing large test files +SHEBANG_GLOB= *.py + NO_ARCH= yes .include diff --git a/science/py-geometric/distinfo b/science/py-geometric/distinfo index 45e88820e97b..436069da4b45 100644 --- a/science/py-geometric/distinfo +++ b/science/py-geometric/distinfo @@ -1,3 +1,3 @@ -TIMESTAMP = 1667893873 -SHA256 (geometric-1.0.tar.gz) = 905f4f1a23f72c80788974e57cf9fcc08730c1d4ce994f1114745c3ebcfd4cce -SIZE (geometric-1.0.tar.gz) = 347922 +TIMESTAMP = 1737789635 +SHA256 (geometric-1.1.tar.gz) = ed7bd2ed67a2f15d442ccc6ce628fdfe682bc3f11ee0566d2edde4830877ed2b +SIZE (geometric-1.1.tar.gz) = 386046