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# Maintainer: Eric Berquist <eric DOT berquist AT gmail DOT com>
_pkgname=nwchem
pkgname=${_pkgname}-bin
_pkgver=7.0.2-1
_pkgver_tmp="${_pkgver//\+/\.}"
pkgver="${_pkgver_tmp//-/\.}"
pkgrel=1
pkgdesc="Open Source High-Performance Computational Chemistry (Debian binary build)"
arch=("x86_64")
url="http://www.nwchem-sw.org"
license=("custom:ECL2.0" "GPL3")
depends=("lapack" "python39" "openmpi" "nwchem-data" "scalapack")
provides=("${_pkgname}")
conflicts=("${_pkgname}")
options=("!strip" "libtool" "staticlibs")
source=("http://ftp.us.debian.org/debian/pool/main/n/nwchem/nwchem_${_pkgver}_amd64.deb")
sha256sums=('45eb58dcc79c54e778748170636147945782cde919584b6a3e1ac816e8f57b77')
package() {
msg2 "Extracting the data.tar.xz..."
bsdtar -xf data.tar.xz -C "${pkgdir}/"
msg2 "Adding license..."
install -Dm644 "${pkgdir}"/usr/share/doc/"${_pkgname}"/copyright "${pkgdir}"/usr/share/licenses/"${pkgname}"/LICENSE
msg2 "Removing Debian extras..."
rm "${pkgdir}"/usr/share/doc/nwchem/changelog.*
rm "${pkgdir}"/usr/share/doc/nwchem/TODO.Debian
rm -r "${pkgdir}"/usr/share/lintian
# Don't modify the scalapack PKGBUILD.
mkdir -p "${pkgdir}"/usr/lib
ln -fsv /usr/lib/libscalapack.so "${pkgdir}"/usr/lib/libscalapack-openmpi.so.2.1
}
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