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author | Hector Martinez-Seara | 2019-01-27 19:45:37 +0100 |
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committer | Hector Martinez-Seara | 2019-01-27 19:45:37 +0100 |
commit | e43ef991e257c34b146d550d5b39c43bb7766e09 (patch) | |
tree | 129e3ee3aa2df52ba632eab3138313cd3feaed20 | |
parent | f2e476b25f76885470a22f226d86987fc76aaebf (diff) | |
download | aur-e43ef991e257c34b146d550d5b39c43bb7766e09.tar.gz |
Updated to nov2018 version
-rw-r--r-- | .SRCINFO | 6 | ||||
-rw-r--r-- | PKGBUILD | 8 |
2 files changed, 7 insertions, 7 deletions
@@ -1,13 +1,13 @@ pkgbase = gromacs-5.0-complete-charmm36 pkgdesc = CHARMM36 force field in GROMACS format. - pkgver = 201411 - pkgrel = 2 + pkgver = 201811 + pkgrel = 1 url = http://mackerell.umaryland.edu/charmm_ff.shtml#gromacs arch = any license = GPL depends = gromacs-5.0-complete=5.0.7 source = http://mackerell.umaryland.edu/download.php?filename=CHARMM_ff_params_files/charmm36-nov2014.ff.tgz - sha1sums = abdccbe077e85ad74bbeb4753617ea748aee5e24 + sha1sums = b953246b458cc6f4ed5bf5ebb761adf5807f6356 pkgname = gromacs-5.0-complete-charmm36 @@ -1,21 +1,21 @@ # Maintainer: Hector <hsearaDOTatDOTgmailDOTcom> pkgname=gromacs-5.0-complete-charmm36 -pkgver=201411 +pkgver=201811 _gromacs_ver=5.0.7 -pkgrel=2 +pkgrel=1 pkgdesc='CHARMM36 force field in GROMACS format.' url='http://mackerell.umaryland.edu/charmm_ff.shtml#gromacs' license=("GPL") arch=('any') depends=("gromacs-5.0-complete=${_gromacs_ver}") source=(http://mackerell.umaryland.edu/download.php?filename=CHARMM_ff_params_files/charmm36-nov2014.ff.tgz) -sha1sums=('abdccbe077e85ad74bbeb4753617ea748aee5e24') +sha1sums=('b953246b458cc6f4ed5bf5ebb761adf5807f6356') package() { msg2 "Installing charmm36 forcefield files in Gromacs" mkdir -p ${pkgdir}/usr/local/gromacs/gromacs-${_gromacs_ver}/share/gromacs/top/charmm36.ff - cp ${srcdir}/charmm36-nov2014.ff/* ${pkgdir}/usr/local/gromacs/gromacs-${_gromacs_ver}/share/gromacs/top/charmm36.ff/ + cp ${srcdir}/charmm36-*/* ${pkgdir}/usr/local/gromacs/gromacs-${_gromacs_ver}/share/gromacs/top/charmm36.ff/ chmod 644 ${pkgdir}/usr/local/gromacs/gromacs-${_gromacs_ver}/share/gromacs/top/charmm36.ff/* } |