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# Copyright 1999-2010 Gentoo Foundation
# Distributed under the terms of the GNU General Public License v2
# $Header: /var/cvsroot/gentoo-x86/sci-chemistry/tinker/tinker-5.1.05.ebuild,v 1.2 2010/04/09 13:33:24 jlec Exp $
EAPI="2"
FORTRAN="gfortran ifc"
inherit fortran
DESCRIPTION="Molecular modeling package that includes force fields, such as AMBER and CHARMM."
HOMEPAGE="http://dasher.wustl.edu/tinker/"
SRC_URI="http://dasher.wustl.edu/tinker/downloads/${P}.tar.gz"
SLOT="0"
LICENSE="Tinker"
KEYWORDS="~amd64 ~x86 ~x86-linux"
IUSE=""
# RDEPEND="dev-java/j3d-core"
RDEPEND="!dev-util/tinker"
RESTRICT="mirror"
S="${WORKDIR}"/tinker/source
src_compile() {
emake \
-f ../make/Makefile \
F77="${FORTRANC}" \
F77FLAGS=-c \
OPTFLAGS="${FFLAGS}" \
LINKFLAGS="${LDFLAGS}" \
|| die
}
src_install() {
dodoc \
"${WORKDIR}"/tinker/doc/{*.txt,announce/release-*,*.pdf,0README} || die
dolib.a libtinker.a || die
for EXE in *.x; do
newbin ${EXE} ${EXE%.x} || die
done
docinto example
dodoc "${WORKDIR}"/tinker/example/* || die
docinto test
dodoc "${WORKDIR}"/tinker/test/* || die
dobin "${WORKDIR}"/tinker/perl/mdavg || die
insinto /usr/share/tinker/params
doins "${WORKDIR}"/tinker/params/* || die
}
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