diff options
| -rw-r--r-- | sci-chemistry/relax/ChangeLog | 7 | ||||
| -rw-r--r-- | sci-chemistry/relax/Manifest | 32 | ||||
| -rw-r--r-- | sci-chemistry/relax/relax-3.1.7.ebuild | 70 |
3 files changed, 93 insertions, 16 deletions
diff --git a/sci-chemistry/relax/ChangeLog b/sci-chemistry/relax/ChangeLog index 8f34d505a7ce..a61b45163cdf 100644 --- a/sci-chemistry/relax/ChangeLog +++ b/sci-chemistry/relax/ChangeLog @@ -1,6 +1,11 @@ # ChangeLog for sci-chemistry/relax # Copyright 1999-2014 Gentoo Foundation; Distributed under the GPL v2 -# $Header: /var/cvsroot/gentoo-x86/sci-chemistry/relax/ChangeLog,v 1.20 2014/03/06 10:26:48 jlec Exp $ +# $Header: /var/cvsroot/gentoo-x86/sci-chemistry/relax/ChangeLog,v 1.21 2014/03/18 07:51:51 jlec Exp $ + +*relax-3.1.7 (18 Mar 2014) + + 18 Mar 2014; Justin Lecher <jlec@gentoo.org> +relax-3.1.7.ebuild: + Version BUmp *relax-3.1.6 (06 Mar 2014) diff --git a/sci-chemistry/relax/Manifest b/sci-chemistry/relax/Manifest index f4f6acc2f8f0..44ccea4af5a4 100644 --- a/sci-chemistry/relax/Manifest +++ b/sci-chemistry/relax/Manifest @@ -20,6 +20,7 @@ DIST relax-3.1.3.src.tar.bz2 70753182 SHA256 9c01e5d3277fcc7cd0574badcbce22f51d9 DIST relax-3.1.4.src.tar.bz2 70770485 SHA256 40377da2f24c7d70d08691d023fd6ca869624d4edbebfd82d78313df7fc0950c SHA512 5225bbac8f577d4d5853de3382929a9b917cabf2418e7984a2dbb34f47a3258a71b132f5c2a04b6ac358ccd25063cb5558ee004f9f495c4a496b75d5ad3e3c87 WHIRLPOOL 8702a979cb7c9196eab9566082e21232f1f0ddb9074073f7a87985ff261e93011c17928dfa621df26b84039e99558588562b872d8a4f6b620bb62711f11b8b1e DIST relax-3.1.5.src.tar.bz2 70768909 SHA256 e8948a19b4e0ed8ce8c05402e4b920ad66a11686fc19ab782c33f888f4a6502f SHA512 4f62a734a5b02fdc2d11b1162de0474bf76c06f221b13677fe9496363c7eaba3c214c1319e3f9fef43b21641329dcefc577125cf69cc50a98d36e1dcddd84027 WHIRLPOOL e3b51ce0f1d83efb3f21fa7f23c57359427739244319b4a1bd4e043c22dc8942b84fa20418a7c450f3bcb0c9549e2b6284e9dac843c70bb7db1a96ea0cc98d8e DIST relax-3.1.6.src.tar.bz2 84506476 SHA256 6a6a085e95c3ccf268a0668042eaa6b1e92595b2a5dc745eb1a13cec4cb63ae9 SHA512 8257cf61b3fb0f19731d15f02afc98c3460e532fe907138d64b62c517945f028bf133dd0c5b3071715935520fad0c02e44042a8a6a5d9a2c254771bfa8f6633a WHIRLPOOL bc7de14eba0576e7d17cc663538f7f6448ac580511ca432fa7820bf27c61b45cf1d76773eac47d626667fde07f5a109a23cc04a5e7b5f5170d5f8bd30e7f1246 +DIST relax-3.1.7.src.tar.bz2 84624222 SHA256 c48883719565253b905e37b380710403b1b099bf7d4ad4edbaec93d808a9a7ba SHA512 48b9b5157841e44319025faaea8799277d0822de78b2c25c0a5785de17d198fa6d802c40bc3113dc604d6e57ecdf943acdd101d561e1136f78fa2ab65e8f9841 WHIRLPOOL 77db59a508592eb185c597fbb2f10b2da9b0f78f56bf1af76bb30dd805ee796b71f75bb3005624b640192629968053b40065ccd278dc979159fedad3819ab69a EBUILD relax-2.1.0.ebuild 1128 SHA256 2d49d317cc424da9f9f2bf86ec802dae614952d506e385a60fa95e262b0c0da3 SHA512 fa76e538545bb5a2d520d3b063ba255f2d4c0279332631f061444a697528f78c6709f3d91a946289bf80828059ff7423b0d3d5374117bf89625f360212540614 WHIRLPOOL 4e0686ab5f70ddd7243c53437978b617ee2a9be55da1eb78022863babeafffae80536048471526e6076553761ea968129e7100c960d6fc7f970b281911d4ba09 EBUILD relax-2.2.1.ebuild 1337 SHA256 4c65b74e17d1928bfc0f42230e1ccbc6abd5963901a751a7782f3c19bf25008c SHA512 70c78139ba9a9a08404673fc970082f9e3c868b2651b80d9f7cac4c5680bec846c69d3c65e68240139dfe37957607845b0ac66f595151ee7051b745d500d095e WHIRLPOOL 219ca572d15297a779da98b2a9f7a12edd80bec89710be07d0d2b02716534c831893a0bc14a0a9f177e6cebc0283c4d25872c4265a7f6f20610c0b17feafd236 EBUILD relax-2.2.5.ebuild 1521 SHA256 f9192d970b2e70dcebdfc6ebd4658459cf5ac88a1b74886cf456108633ccf2c3 SHA512 7a4f13a4be29ef48082e82e6ec7bc6f6b3e1da72ed32e914b9f202c83f61868d850f3c4f2410407ad4c1be5ce5939fb16330d403bcdbdea12fc69e0070a15007 WHIRLPOOL ba6768c596b799456d18f85450520b7de81b5688df9ec3762023b54bf82f3398ed9eea862d242a064ffd3f71f8f73315b15d8734ace7a0196e4fc0b82be8ad99 @@ -32,25 +33,26 @@ EBUILD relax-3.1.3.ebuild 1606 SHA256 d726480185f5659a60c43fe0d648ec4d494c1a000e EBUILD relax-3.1.4.ebuild 1593 SHA256 00c3a7608bc119bbebd8996d4724d2af8041fcc1e3216a3f9e4d4cdc014876b6 SHA512 8b9c92b5ce59c0bb1cc3598da71a5c4c7b8a3571dc5039d39b84def149e72d95947503f93bd871309bacc4f1b37552b85cf227689c398bfe306cbbfda90d9f26 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under the terms of the GNU General Public License v2 +# $Header: /var/cvsroot/gentoo-x86/sci-chemistry/relax/relax-3.1.7.ebuild,v 1.1 2014/03/18 07:51:51 jlec Exp $ + +EAPI=5 + +PYTHON_COMPAT=( python2_7 ) + +WX_GTK_VER="2.9" + +inherit eutils multiprocessing python-single-r1 scons-utils toolchain-funcs wxwidgets virtualx + +DESCRIPTION="Molecular dynamics by NMR data analysis" +HOMEPAGE="http://www.nmr-relax.com/" +SRC_URI="http://download.gna.org/relax/${P}.src.tar.bz2" + +SLOT="0" +LICENSE="GPL-2" +KEYWORDS="~amd64 ~x86 ~amd64-linux ~x86-linux" +IUSE="" + +REQUIRED_USE="${PYTHON_REQUIRED_USE}" + +RDEPEND=" + ${PYTHON_DEPS} + dev-python/numpy[${PYTHON_USEDEP}] + dev-python/wxpython:${WX_GTK_VER}[${PYTHON_USEDEP}] + sci-chemistry/molmol + sci-chemistry/pymol[${PYTHON_USEDEP}] + sci-chemistry/vmd + >=sci-libs/bmrblib-1.0.3[${PYTHON_USEDEP}] + >=sci-libs/minfx-1.0.5[${PYTHON_USEDEP}] + sci-libs/scipy[${PYTHON_USEDEP}] + sci-visualization/grace + sci-visualization/opendx + x11-libs/wxGTK:${WX_GTK_VER}[X]" +DEPEND="${RDEPEND} + media-gfx/pngcrush" + +pkg_setup() { + python-single-r1_pkg_setup +} + +src_prepare() { + local png + rm -rf minfx bmrblib || die + epatch \ + "${FILESDIR}"/${PN}-3.0.1-gentoo.patch + tc-export CC +} + +src_compile() { + escons +} + +src_test() { + VIRTUALX_COMMAND="${EPYTHON} ./${PN}.py -x" + virtualmake +} + +src_install() { + dodoc README docs/{CHANGES,COMMITTERS,JOBS,relax.pdf,prompt_screenshot.txt} + + python_moduleinto ${PN} + python_domodule * + + rm ${PN} README || die + + make_wrapper ${PN}-nmr "${EPYTHON} $(python_get_sitedir)/${PN}/${PN}.py $@" +} |