26 lines
648 B
Makefile
26 lines
648 B
Makefile
PORTNAME= pyberny
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DISTVERSION= 0.6.3
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CATEGORIES= science # chemistry
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MASTER_SITES= PYPI
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PKGNAMEPREFIX= ${PYTHON_PKGNAMEPREFIX}
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MAINTAINER= yuri@FreeBSD.org
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COMMENT= Optimizer of molecular geometries with respect to the total energy
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WWW= https://github.com/jhrmnn/pyberny
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LICENSE= MPL20
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LICENSE_FILE= ${WRKSRC}/LICENSE
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RUN_DEPENDS= ${PYNUMPY}
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TEST_DEPENDS= ${PYTHON_PKGNAMEPREFIX}pytest>0:devel/py-pytest@${PY_FLAVOR}
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USES= python:3.5+
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USE_PYTHON= distutils concurrent autoplist
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NO_ARCH= yes
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do-test: install # no tests run, see https://github.com/jhrmnn/pyberny/issues/36
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@cd ${WRKSRC} && pytest -rs --pyargs berny
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.include <bsd.port.mk>
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