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author | James Barnett | 2016-12-31 11:24:27 -0600 |
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committer | James Barnett | 2016-12-31 11:24:27 -0600 |
commit | 88da4df56ee308e1e8c0e67b538e499dc295af3c (patch) | |
tree | d794db117eb81297850b05e1f1568f1028451e72 /PKGBUILD | |
download | aur-python-pymbar-git.tar.gz |
initial commit
Diffstat (limited to 'PKGBUILD')
-rw-r--r-- | PKGBUILD | 32 |
1 files changed, 32 insertions, 0 deletions
diff --git a/PKGBUILD b/PKGBUILD new file mode 100644 index 000000000000..e5fb8155c326 --- /dev/null +++ b/PKGBUILD @@ -0,0 +1,32 @@ +# Maintainer James W. Barnett <jbarnet4 at tulane dot edu> +pkgname=python-pymbar-git +pkgver=r453.dc0fd3f +pkgrel=1 +pkgdesc="Python implementation of the multistate Bennett acceptance ratio (MBAR) method for estimating expectations and free energy differences. " +arch=('i686' 'x86_64') +url="https://github.com/choderalab/pymbar" +license=('LGPL') +depends=('python' 'python-numpy' 'python-scipy' 'python-six') +makedepends=('git' 'python-nose' 'python-statsmodels') +source=('git://github.com/choderalab/pymbar.git') +sha512sums=('SKIP') + +pkgver() { + cd "$srcdir/pymbar" + git describe --tags | sed 's/^v//;s/\([^-]*-g\)/r\1/;s/-/./g' +} + +build() { + cd "$srcdir/pymbar" + python setup.py build +} + +check() { + cd "$srcdir/pymbar" + nosetests ./pymbar +} + +package() { + cd "$srcdir/pymbar" + python setup.py install -O2 --root=$pkgdir || return 1 +} |