# $FreeBSD$

PORTNAME=	qcelemental
PORTVERSION=	0.12.0
CATEGORIES=	science python
MASTER_SITES=	CHEESESHOP
PKGNAMEPREFIX=	${PYTHON_PKGNAMEPREFIX}

MAINTAINER=	yuri@FreeBSD.org
COMMENT=	Essentials for quantum chemistry

LICENSE=	BSD3CLAUSE
LICENSE_FILE=	${WRKSRC}/LICENSE

RUN_DEPENDS=	${PYNUMPY} \
		${PYTHON_PKGNAMEPREFIX}Pint>0:devel/py-Pint@${PY_FLAVOR} \
		${PYTHON_PKGNAMEPREFIX}pydantic>=1.0.0:devel/py-pydantic@${PY_FLAVOR}

USES=		python:3.6+
USE_PYTHON=	distutils autoplist

NO_ARCH=	yes

.include <bsd.port.mk>