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author | Reinis Danne <rei4dan@gmail.com> | 2014-01-10 00:00:17 +0200 |
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committer | Reinis Danne <rei4dan@gmail.com> | 2014-01-10 00:00:17 +0200 |
commit | 0b2850fab6f2263a90fafb5496706f891d837aeb (patch) | |
tree | 269fd73f7411a378382e90b14b4140f2545338f1 | |
parent | Merge remote-tracking branch 'github/master' (diff) | |
download | sci-0b2850fab6f2263a90fafb5496706f891d837aeb.tar.gz sci-0b2850fab6f2263a90fafb5496706f891d837aeb.tar.bz2 sci-0b2850fab6f2263a90fafb5496706f891d837aeb.zip |
Add sci-libs/pmx
-rw-r--r-- | sci-libs/pmx/ChangeLog | 10 | ||||
-rw-r--r-- | sci-libs/pmx/metadata.xml | 13 | ||||
-rw-r--r-- | sci-libs/pmx/pmx-9999.ebuild | 26 |
3 files changed, 49 insertions, 0 deletions
diff --git a/sci-libs/pmx/ChangeLog b/sci-libs/pmx/ChangeLog new file mode 100644 index 000000000..0cb571fbb --- /dev/null +++ b/sci-libs/pmx/ChangeLog @@ -0,0 +1,10 @@ +# ChangeLog for sci-libs/pmx +# Copyright 1999-2014 Gentoo Foundation; Distributed under the GPL v2 +# $Header: $ + +*pmx-9999 (09 Jan 2014) + + 09 Jan 2014; Reinis Danne <rei4dan@gmail.com> +pmx-9999.ebuild, + +metadata.xml: + New ebuild. + diff --git a/sci-libs/pmx/metadata.xml b/sci-libs/pmx/metadata.xml new file mode 100644 index 000000000..ae81f58a6 --- /dev/null +++ b/sci-libs/pmx/metadata.xml @@ -0,0 +1,13 @@ +<?xml version="1.0" encoding="UTF-8"?> +<!DOCTYPE pkgmetadata SYSTEM "http://www.gentoo.org/dtd/metadata.dtd"> +<pkgmetadata> + <herd>sci-chemistry</herd> + <longdescription> + pmx (formerly pymacs) has started as a small bunch of classes to read + structure files such as pdb or gro and trajectory data in gromacs xtc + format. Over the years it has been extended towards a versatile (bio-) + molecular structure manipulation package with some additional + functionalities, e.g. gromacs file parsers and scripts for setup and + analysis of free energy calculations. + </longdescription> +</pkgmetadata> diff --git a/sci-libs/pmx/pmx-9999.ebuild b/sci-libs/pmx/pmx-9999.ebuild new file mode 100644 index 000000000..2d073e420 --- /dev/null +++ b/sci-libs/pmx/pmx-9999.ebuild @@ -0,0 +1,26 @@ +# Copyright 1999-2014 Gentoo Foundation +# Distributed under the terms of the GNU General Public License v2 +# $Header: $ + +EAPI=5 + +PYTHON_COMPAT=( python{2_6,2_7} ) + +inherit eutils distutils-r1 git-r3 + +DESCRIPTION="Python library to read PDB, GRO or Gromacs XTC files" +HOMEPAGE="http://code.google.com/p/pmx" +EGIT_REPO_URI="https://code.google.com/p/${PN}.git" +EGIT_NONSHALLOW=true + +LICENSE="LGPL-3" +SLOT="0" +IUSE="" + +DEPEND="${DEPEND} + sci-chemistry/gromacs + sci-libs/scipy[${PYTHON_USEDEP}] + dev-python/numpy[${PYTHON_USEDEP}] + " + +RDEPEND="${DEPEND}" |