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49 lines
2.2 KiB
Bash
49 lines
2.2 KiB
Bash
# $Id: PKGBUILD 57440 2011-10-27 20:16:15Z lcarlier $
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# Maintainer: Eduardo Martins Lopes "duca" <edumlopes@gmail.com>
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# Maintainer: Abhishek Dasgupta <abhidg@gmail.com>
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# Contributor: Ricardo <rikardo.horo@gmail.com>
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# Contributor: Hector <hsearaDOTatDOTgmailDOTcom>
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pkgname=gromacs4
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_pkgname=gromacs
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pkgver=4.5.5
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pkgrel=1
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pkgdesc='A versatile package to perform molecular dynamics. Old version'
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url='http://www.gromacs.org/'
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license=("GPL")
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arch=('i686' 'x86_64')
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depends=('fftw' 'lesstif' 'perl' 'libxml2' 'libsm' 'libx11')
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makedepends=('cmake')
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options=('!libtool')
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source=(ftp://ftp.gromacs.org/pub/gromacs/${_pkgname}-${pkgver}.tar.gz)
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md5sums=('6a87e7cdfb25d81afa9fea073eb28468')
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build() {
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mkdir -p "${srcdir}/double"
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msg2 "Building the doulbe precision files"
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cd "${srcdir}/double"
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cmake -DCMAKE_PREFIX=/opt/gromacs_old/ -DCMAKE_INSTALL_PREFIX=/opt/gromacs_old/ -DGMX_THREADS=ON -DGMX_SHARED_LIBS=ON -DGMX_DOUBLE=ON -DGMX_X11=ON -DGMX_DEFAULT_SUFFIX=OFF -DGMX_LIBS_SUFFIX=_4.5 -DGMX_BINARY_SUFFIX=_4.5 ../${_pkgname}-${pkgver}/
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make -j5
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}
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package() {
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mkdir -p "${pkgdir}/etc/profile.d/"
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mkdir -p "${pkgdir}/usr/share/bash-completion/completions"
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# Cleaning up, kept the csh completion at default location
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msg2 "Making the double precision executables"
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cd "${srcdir}/double"
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make DESTDIR="${pkgdir}" install
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# installing completions in correct location and environment setup script
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install -D -m755 "${srcdir}/${_pkgname}-${pkgver}/scripts/completion.bash" "${pkgdir}/usr/share/bash-completion/completions/gromacs_old"
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mv "${pkgdir}/opt/gromacs_old/bin/GMXRC.bash" "${pkgdir}/etc/profile.d/GMXRC_OLD.bash"
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mv "${pkgdir}/opt/gromacs_old/bin/GMXRC.zsh" "${pkgdir}/etc/profile.d/GMXRC_OLD.zsh"
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mv "${pkgdir}/opt/gromacs_old/bin/GMXRC.csh" "${pkgdir}/etc/profile.d/GMXRC_OLD.csh"
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sed "s:/opt/gromacs_old/bin:/etc/profile.d:g" "${pkgdir}/opt/gromacs_old/bin/GMXRC" > "${pkgdir}/etc/profile.d/GMXRC"
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sed -e "s/GMXRC/GMXRC_OLD/g" "${pkgdir}/etc/profile.d/GMXRC" > "${pkgdir}/etc/profile.d/GMXRC_OLD"
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chmod 755 "${pkgdir}/etc/profile.d/GMXRC_OLD"
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rm -f "${pkgdir}/etc/profile.d/GMXRC"
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rm -f "${pkgdir}/opt/gromacs_old/bin/completion.*"
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rm -f "${pkgdir}/opt/gromacs_old/bin/GMXRC"
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}
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