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author | 2004-12-24 16:40:49 +0000 | |
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committer | 2004-12-24 16:40:49 +0000 | |
commit | d39ddfb101893f84b26af91fa07ba9220a94fbb4 (patch) | |
tree | 2fae42b43fbe361cf6e66603aa5cc9dbc3eeab88 /app-sci | |
parent | Moved from app-sci/gperiodic to sci-chemistry/gperiodic (diff) | |
download | gentoo-2-d39ddfb101893f84b26af91fa07ba9220a94fbb4.tar.gz gentoo-2-d39ddfb101893f84b26af91fa07ba9220a94fbb4.tar.bz2 gentoo-2-d39ddfb101893f84b26af91fa07ba9220a94fbb4.zip |
Moving to sci-chemistry/gromacs
Diffstat (limited to 'app-sci')
-rw-r--r-- | app-sci/gromacs/ChangeLog | 74 | ||||
-rw-r--r-- | app-sci/gromacs/Manifest | 4 | ||||
-rw-r--r-- | app-sci/gromacs/files/digest-gromacs-3.2.1 | 1 | ||||
-rw-r--r-- | app-sci/gromacs/gromacs-3.2.1.ebuild | 66 | ||||
-rw-r--r-- | app-sci/gromacs/metadata.xml | 9 |
5 files changed, 0 insertions, 154 deletions
diff --git a/app-sci/gromacs/ChangeLog b/app-sci/gromacs/ChangeLog deleted file mode 100644 index 9f0279a819b2..000000000000 --- a/app-sci/gromacs/ChangeLog +++ /dev/null @@ -1,74 +0,0 @@ -# ChangeLog for app-sci/gromacs -# Copyright 2002-2004 Gentoo Foundation; Distributed under the GPL v2 -# $Header: /var/cvsroot/gentoo-x86/app-sci/gromacs/ChangeLog,v 1.14 2004/06/24 22:02:11 agriffis Exp $ - - 06 Jun 2004; Danny van Dyk <kugelfang@gentoo.org> gromacs-3.2.1.ebuild: - Marked stable on amd64. - - 22 Apr 2004; Donnie Berkholz <spyderous@gentoo.org>; - -files/gromacs-3.2-all-static-fix.patch, -gromacs-3.1.4-r1.ebuild, - -gromacs-3.1.4-r2.ebuild, gromacs-3.2.1.ebuild, -gromacs-3.2.ebuild: - Mark 3.2.1 stable on x86. Remove old versions. - - 22 Apr 2004; Donnie Berkholz <spyderous@gentoo.org>; - gromacs-3.1.4-r1.ebuild, gromacs-3.2.1.ebuild: - Add app-shells/tcsh to dependencies (#48691). - - 22 Apr 2004; Danny van Dyk <kugelfang@gentoo.org> gromacs-3.2.1.ebuild: - marked ~amd64 - -*gromacs-3.2.1 (02 Apr 2004) - - 02 Apr 2004; Donnie Berkholz <spyderous@gentoo.org>; gromacs-3.2.1.ebuild: - Version bump, closes #44377. - -*gromacs-3.2 (29 Feb 2004) - - 29 Feb 2004; Donnie Berkholz <spyderous@gentoo.org>; gromacs-3.2.ebuild, - files/gromacs-3.2-all-static-fix.patch: - Version bump. New xml2 USE flag. - -*gromacs-3.1.4-r2 (28 Feb 2004) - - 28 Feb 2004; Donnie Berkholz <spyderous@gentoo.org>; - gromacs-3.1.4-r2.ebuild: - Closing bug #42989 by installing binaries to /usr/bin. Also discovered libs - needed to be installed to /usr/lib. Enabled assembly for Alphas too, if any - Alpha user ever tries this. - - 04 Oct 2003; Donnie Berkholz <spyderous@gentoo.org>; gromacs-3.1.3.ebuild, - gromacs-3.1.4.ebuild: - Pulling old versions. - - 04 Oct 2003; Donnie Berkholz <spyderous@gentoo.org>; - gromacs-3.1.4-r1.ebuild: - Fixing fftw dep. Won't compile against fftw-3 yet, in part because it looks - for fftw3.h instead of fftw.h, and in part because MPI doesn't work in fftw-3 - yet. - -*gromacs-3.1.4-r1 (23 Mar 2003) - - 23 Mar 2003; George Shapovalov <george@gentoo.org> gromacs-3.1.4-r1.ebuild : - added mpi support, lam-mpi is the only working implementation at the moment. - !IMPORTANT!: - Since portage cannot at present check whether optional dependencies of dependencies were turned on, - please check yourself that gromacs and fftw have identical mpi setting. - Generally USE="mpi" emerge gromacs should work fine if you did not install fftw previously (with - different mpi off for example). - -*gromacs-3.1.4 (08 Nov 2002) - - 08 Nov 2002; George Shapovalov <george@gentoo.org> gromacs-3.1.4.ebuild, files/digest-gromacs-3.1.4 : - - new version. - !!!IMPORTANT!!! - I changed --prefix to point to /usr for FHS compliance. - Now the binaries and the libs are getting installed into - /usr/i686-pc-linux-gnu/{bin,lib} correspondingly and the data into /usr/share/gromacs-${PV} - This seems to fit well in the existing direcory structure and does not conflict with gcc. - -*gromacs-3.1.3 (27 Apr 2002) - - 27 Apr 2002; George Shapovalov <george@gentoo.org> all_files : - - initial release. diff --git a/app-sci/gromacs/Manifest b/app-sci/gromacs/Manifest deleted file mode 100644 index c6d395ff8723..000000000000 --- a/app-sci/gromacs/Manifest +++ /dev/null @@ -1,4 +0,0 @@ -MD5 19d76fe83eec7daeb93be37ddf80c48d ChangeLog 2900 -MD5 af1bfbb0777267a03e889b08173f2757 metadata.xml 248 -MD5 52f9213641edab2cd66394df116f9d70 gromacs-3.2.1.ebuild 1897 -MD5 e6cada3bcb0c80d058e7be754fde4612 files/digest-gromacs-3.2.1 66 diff --git a/app-sci/gromacs/files/digest-gromacs-3.2.1 b/app-sci/gromacs/files/digest-gromacs-3.2.1 deleted file mode 100644 index a81d8da1b86b..000000000000 --- a/app-sci/gromacs/files/digest-gromacs-3.2.1 +++ /dev/null @@ -1 +0,0 @@ -MD5 d298386495f6ee39b3155ce951984485 gromacs-3.2.1.tar.gz 3302723 diff --git a/app-sci/gromacs/gromacs-3.2.1.ebuild b/app-sci/gromacs/gromacs-3.2.1.ebuild deleted file mode 100644 index 5266ac461855..000000000000 --- a/app-sci/gromacs/gromacs-3.2.1.ebuild +++ /dev/null @@ -1,66 +0,0 @@ -# Copyright 1999-2004 Gentoo Foundation -# Distributed under the terms of the GNU General Public License v2 -# $Header: /var/cvsroot/gentoo-x86/app-sci/gromacs/gromacs-3.2.1.ebuild,v 1.6 2004/06/24 22:02:11 agriffis Exp $ - -inherit eutils - -IUSE="mpi xml2" - -DESCRIPTION="The ultimate molecular dynamics simulation package" -SRC_URI="ftp://ftp.gromacs.org/pub/${PN}/${P}.tar.gz" -HOMEPAGE="http://www.gromacs.org/" - -LICENSE="GPL-2" -SLOT="0" -KEYWORDS="x86 amd64" - -#mpi is a local USE flag now -#May become official when situation with mpich is cleared (now the only mpi implementation awailable is lam-mpi) -DEPEND="=dev-libs/fftw-2.1* - mpi? ( >=sys-cluster/lam-mpi-6.5.6 ) - >=sys-devel/binutils-2.10.91.0.2 - app-shells/tcsh - xml2? ( dev-libs/libxml2 )" - -src_compile() { -#!!!Please note!!! -#for troublesome work gromacs should be compiled with the same mpi setting as fftw. -#Unfortunately portage cannot trace optional dependencies of dependencies at present. -#Until this (planned) feature is completed, please try to do corresponding check yourself. - local myconf - - # Enable asm on Alphas - if [ "${ARCH}" = "alpha" ] - then - myconf="${myconf} --enable-axp-asm" - fi - - # static should work but something's broken. - # gcc spec file may be screwed up. - # Static linking should try -lgcc instead of -lgcc_s. - # For more info: - # http://lists.debian.org/debian-gcc/2002/debian-gcc-200201/msg00150.html - econf \ - --enable-fortran \ - --datadir=/usr/share/${P} \ - --bindir=/usr/bin \ - --libdir=/usr/lib \ - `use_with xml2 xml` \ - `use_enable mpi` \ - ${myconf} || die "configure failed" - - # `use_enable static all-static` \ - - emake || die -} - -src_install () { - make DESTDIR=${D} install || die - - # Install documentation. - dodoc AUTHORS COPYING INSTALL README - - #move html docs under /usr/share/doc - #and leave examples and templates under /usr/gromacs... - mv ${D}/usr/share/${P}/html ${D}/usr/share/doc/${PF} -} diff --git a/app-sci/gromacs/metadata.xml b/app-sci/gromacs/metadata.xml deleted file mode 100644 index 211b8bd0f0a4..000000000000 --- a/app-sci/gromacs/metadata.xml +++ /dev/null @@ -1,9 +0,0 @@ -<?xml version="1.0" encoding="UTF-8"?> -<!DOCTYPE pkgmetadata SYSTEM "http://www.gentoo.org/dtd/metadata.dtd"> -<pkgmetadata> -<herd>sci</herd> -<maintainer> -<email>spyderous@gentoo.org</email> -<name>Donnie Berkholz</name> -</maintainer> -</pkgmetadata> |