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gentoo-overlay/sci-chemistry/acpype/acpype-0.1.0.ebuild

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649 B

# Copyright 1999-2017 Gentoo Foundation
# Distributed under the terms of the GNU General Public License v2
EAPI=6
PYTHON_COMPAT=( python2_7 )
inherit distutils-r1
DESCRIPTION="AnteChamber PYthon Parser interfacE"
HOMEPAGE="https://github.com/llazzaro"
SRC_URI="https://github.com/llazzaro/${PN}/archive/${PV}.tar.gz -> ${P}.tar.gz"
LICENSE="MIT"
SLOT="0"
KEYWORDS="~amd64 ~x86 ~amd64-linux"
IUSE=""
REQUIRED_USE="${PYTHON_REQUIRED_USE}"
DEPEND="
${PYTHON_DEPS}
sci-chemistry/openbabel
sci-chemistry/ambertools"
RDEPEND="${DEPEND}"
src_prepare() {
sed \
-e '1s:^:#!/usr/bin/python\n\n:g' \
-i acpype/CcpnToAcpype.py || die
default
}