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# ChangeLog for sci-chemistry/gamess
# Copyright 1999-2011 Gentoo Foundation; Distributed under the GPL v2
# $Header: /var/cvsroot/gentoo-x86/sci-chemistry/gamess/ChangeLog,v 1.49 2011/01/23 12:42:58 alexxy Exp $
*gamess-20101001.1-r1 (23 Jan 2011)
23 Jan 2011; Alexey Shvetsov <alexxy@gentoo.org> -gamess-20101001.1.ebuild,
+gamess-20101001.1-r1.ebuild, +files/gamess-neo-fix.patch:
Fix neo build for gamess
29 Dec 2010; Alexey Shvetsov <alexxy@gentoo.org>
-gamess-20090112.1-r1.ebuild, -files/gamess-20090112.1.gentoo.patch,
gamess-20101001.1.ebuild:
Fix gamess build. Aslo remove old versions since upstream provides only
latest tarball
20 Dec 2010; Justin Lecher <jlec@gentoo.org> gamess-20090112.1-r1.ebuild,
gamess-20101001.1.ebuild:
Fix for fortran detection, thanks alexxy noting this
16 Dec 2010; Justin Lecher <jlec@gentoo.org> gamess-20090112.1-r1.ebuild,
gamess-20101001.1.ebuild:
Removal of fortran.eclass, #348851
08 Dec 2010; Alexey Shvetsov <alexxy@gentoo.org> gamess-20101001.1.ebuild:
Fix neo code
07 Dec 2010; Alexey Shvetsov <alexxy@gentoo.org> gamess-20101001.1.ebuild,
+files/gamess-qmmm-tinker-fix-idate.patch, metadata.xml:
Make neo optional also fix qmmm compilation
*gamess-20101001.1 (07 Dec 2010)
07 Dec 2010; Alexey Shvetsov <alexxy@gentoo.org> -gamess-20080411.1.ebuild,
-files/gamess-20080411.1.gentoo.patch, -gamess-20090112.1.ebuild,
-gamess-20090112.3.ebuild, -gamess-20090112.3-r1.ebuild,
-gamess-20100325.2.ebuild, -files/gamess-20100325.2.gentoo.patch,
+gamess-20101001.1.ebuild, +files/gamess-20101001.1.gentoo.patch:
Add new gamess release. Clean up old ones. TODO: Add cuda support and fix
broken mpi stuff
12 Aug 2010; Kacper Kowalik <xarthisius@gentoo.org>
gamess-20100325.2.ebuild:
Add missing depend on dev-util/pkgconfig wrt bug 332439. Thanks to Malcolm
Galland <MalcolmGalland@letu.edu> for reporting.
30 May 2010; Alexey Shvetsov <alexxy@gentoo.org> gamess-20100325.2.ebuild,
+files/gamess-20100325.2.gentoo.patch:
make it build with new buildsystem
*gamess-20100325.2 (24 May 2010)
24 May 2010; Alexey Shvetsov <alexxy@gentoo.org>
+gamess-20100325.2.ebuild:
Version bump with improved qmmm stuff
30 Nov 2009; Alexey Shvetsov <alexxy@gentoo.org>
gamess-20090112.3-r1.ebuild:
Fix typo
*gamess-20090112.3-r1 (30 Nov 2009)
30 Nov 2009; Alexey Shvetsov <alexxy@gentoo.org>
+gamess-20090112.3-r1.ebuild:
Enable mpi build for gamess-us
07 Nov 2009; Mounir Lamouri <volkmar@gentoo.org>
gamess-20090112.1-r1.ebuild:
Stable on ppc, bug 268848
*gamess-20090112.3 (23 Oct 2009)
23 Oct 2009; Markus Dittrich <markusle@gentoo.org>
-gamess-20070324.1.ebuild, -files/gamess-20070324.1.gentoo.patch,
-gamess-20070324.3.ebuild, -files/gamess-20070324.3.gentoo.patch,
-gamess-20070324.6.ebuild, +gamess-20090112.3.ebuild:
Version bump and removed old ebuilds.
07 Jul 2009; Diego E. Pettenò <flameeyes@gentoo.org>
gamess-20090112.1-r1.ebuild:
Use elog for fetch error.
23 May 2009; Markus Meier <maekke@gentoo.org> gamess-20090112.1-r1.ebuild:
amd64 stable, bug #268848
15 May 2009; Christian Faulhammer <fauli@gentoo.org>
gamess-20090112.1-r1.ebuild:
stable x86, bug 268848
23 Apr 2009; Alexey Shvetsov <alexxy@gentoo.org> gamess-20090112.1-r1:
Add support of adjusting MM size at build time
*gamess-20090112.1-r1 (22 Apr 2009)
22 Apr 2009; Alexey Shvetsov <alexxy@gentoo.org> metadata.xml,
+gamess-20090112.1-r1.ebuild:
Add QM/MM support to GAMESS-US
*gamess-20090112.1 (20 Feb 2009)
20 Feb 2009; Alexey Shvetsov <alexxy@gentoo.org>
+files/gamess-20090112.1.gentoo.patch, metadata.xml,
+gamess-20090112.1.ebuild:
Version bump (bug #258062). Add myself to metadata.xml
12 Oct 2008; Markus Dittrich <markusle@gentoo.org>
files/gamess-20080411.1.gentoo.patch:
Made slight change to rungms script to allow parallel runs via
environmental variables (see bug #241394). Thanks much to Alexey
Shvetsov <alexxyum@gmail.com> for the suggestion.
29 Jun 2008; Torsten Veller <tove@gentoo.org> gamess-20070324.1.ebuild,
gamess-20070324.3.ebuild, gamess-20070324.6.ebuild,
gamess-20080411.1.ebuild:
Add missing die: || "..." -> || die "..."
11 May 2008; Christian Faulhammer <opfer@gentoo.org>
gamess-20070324.1.ebuild:
revert stable KEYWORDS because the tarball is restricted and old ones won't
be available from upstream. Requested by markusle by mail
10 May 2008; Markus Dittrich <markusle@gentoo.org>
+gamess-20070324.1.ebuild:
Re-added accidentally removed stable version.
*gamess-20080411.1 (08 May 2008)
08 May 2008; Markus Dittrich <markusle@gentoo.org>
-files/gamess-20060907.4.gentoo.patch,
-files/gamess-20070324.1.gentoo.patch,
+files/gamess-20080411.1.gentoo.patch, -gamess-20060907.4.ebuild,
-gamess-20070324.1.ebuild, +gamess-20080411.1.ebuild:
Version bump (fixes bug #220855).
*gamess-20070324.6 (18 Mar 2008)
18 Mar 2008; Markus Dittrich <markusle@gentoo.org>
+gamess-20070324.6.ebuild:
Version bump.
*gamess-20070324.3 (27 Oct 2007)
27 Oct 2007; Markus Dittrich <markusle@gentoo.org>
+files/gamess-20070324.3.gentoo.patch, +gamess-20070324.3.ebuild:
Version bump and keyworded gamess for amd64.
An external blas library is now mandatory.
19 Aug 2007; Markus Dittrich <markusle@gentoo.org>
gamess-20070324.1.ebuild:
Fixed bad RDEPEND.
03 Jul 2007; Christian Faulhammer <opfer@gentoo.org>
gamess-20070324.1.ebuild:
stable x86, bug 183881
*gamess-20070324.1 (17 Apr 2007)
17 Apr 2007; Markus Dittrich <markusle@gentoo.org>
-files/gamess-glibc-2.4-gentoo.patch, -files/comp-lked-20060222.2.patch,
-files/rungms-runall-20060222.2.patch,
-files/gamess-20060222.5.gentoo.patch,
+files/gamess-20070324.1.gentoo.patch, -files/ddi-use-ssh-gentoo.patch,
+gamess-20070324.1.ebuild:
Version bump and cleaned up unused patches.
07 Jan 2007; Danny van Dyk <kugelfang@gentoo.org>
-gamess-20060222.2.ebuild, -gamess-20060222.5.ebuild:
QA: Removed unused versions.
*gamess-20060907.4 (14 Dec 2006)
14 Dec 2006; Markus Dittrich <markusle@gentoo.org>
+files/gamess-20060907.4.gentoo.patch, +gamess-20060907.4.ebuild:
Version bump. This version includes the NEO code.
*gamess-20060222.5 (26 Sep 2006)
26 Sep 2006; Markus Dittrich <markusle@gentoo.org>
+files/gamess-20060222.5.gentoo.patch, -files/comp-gentoo.patch,
-files/compall-gentoo.patch, -files/compddi-gentoo.patch,
-files/lked-gentoo.patch, -files/runall-gentoo.1.patch,
-files/rungms-gentoo.1.patch, -gamess-05272005.5.ebuild,
+gamess-20060222.5.ebuild:
Version bump (see bug #149118). Also removed one old ebuild and
its accompanying files.
20 Sep 2006; Donnie Berkholz <dberkholz@gentoo.org>; metadata.xml:
(#148281) Change herd to sci-chemistry from sci.
30 Jun 2006; Markus Dittrich <markusle@gentoo.org>
gamess-20060222.2.ebuild:
Changed the ebuild to provide the test scripts used to validate
the gamess test runs. This fixes bug #138516.
23 Jun 2006; Markus Dittrich <markusle@gentoo.org>
gamess-20060222.2.ebuild:
Disable linking against external blas when compiling with ifc and
print out a warning.
23 May 2006; Markus Dittrich <markusle@gentoo.org>
gamess-20060222.2.ebuild:
Removed ifc use flag and replaced it with fortran.eclass logic.
14 May 2006; Donnie Berkholz <spyderous@gentoo.org>;
gamess-05272005.5.ebuild, gamess-20060222.2.ebuild:
Convert leading spaces to tabs.
14 May 2006; Donnie Berkholz <spyderous@gentoo.org>;
gamess-20060222.2.ebuild:
Keyword ~ppc. Also make sure to strip -malign-double on non-x86 systems.
28 Mar 2006; Markus Dittrich <markusle@gentoo.org>
+files/gamess-glibc-2.4-gentoo.patch, gamess-20060222.2.ebuild:
Added patch to fix missing CLK_TCK with glibc-2.4. Thanks to
Jaroslaw Kalinowski <jak137@o2.pl> for pointing this out. This
fixes bug #127784.
*gamess-20060222.2 (22 Mar 2006)
22 Mar 2006; Markus Dittrich <markusle@gentoo.org>
+files/comp-lked-20060222.2.patch, +files/rungms-runall-20060222.2.patch,
-files/comp-gentoo.1.patch, -files/runall-gentoo.patch,
-files/rungms-gentoo.patch, -gamess-05272005.3.ebuild,
-gamess-05272005.3-r1.ebuild, -gamess-05272005.3-r2.ebuild,
+gamess-20060222.2.ebuild:
Version bump and changed the ebuild naming convention to start with
the year since otherwise portage can't properly keep track of
updates. Also removed obsolete ebuilds/patches. gcc-4.1 currently
generates bad binaries even with very conservative compile flags.
08 Feb 2006; Markus Dittrich <markusle@gentoo.org>
gamess-05272005.5.ebuild:
Made ebuild ready to compile and run properly using gfortran.
23 Jan 2006; Markus Dittrich <markusle@gentoo.org>
files/digest-gamess-05272005.5, Manifest:
Fixed improper digest. This resolves bug #119994.
*gamess-05272005.5 (20 Jan 2006)
20 Jan 2006; Markus Dittrich <markusle@gentoo.org>
+gamess-05272005.5.ebuild:
Bump to latest revision 27 JUN 2005 (R5).
*gamess-05272005.3-r2 (07 Dec 2005)
07 Dec 2005; Markus Dittrich <markusle@gentoo.org>
+files/comp-gentoo.1.patch, +gamess-05272005.3-r2.ebuild:
This revision has the TDHF code enabled, which should now work properly with
the patched g77 (see bug #114367).
*gamess-05272005.3-r1 (04 Dec 2005)
04 Dec 2005; Markus Dittrich <markusle@gentoo.org>
+files/runall-gentoo.1.patch, +files/rungms-gentoo.1.patch,
+gamess-05272005.3-r1.ebuild:
This new revision installs the rungms wrapper into /usr/bin to avoid that
users have to copy it manually and to play well with WebMO.
*gamess-05272005.3 (03 Dec 2005)
03 Dec 2005; Markus Dittrich <markusle@gentoo.org>
files/rungms-gentoo.patch, -gamess-05272005.ebuild,
+gamess-05272005.3.ebuild:
Bumped GAMESS to most recent version and changed ebuild naming to properly
reflect the revision number; this fixes bug #114278. Removed old ebuild.
08 Nov 2005; Markus Dittrich <markusle@gentoo.org> ChangeLog:
marked gamess-05272005.ebuild as ~x86
*gamess-05272005 (20 Sep 2005)
20 Sep 2005; Olivier Fisette <ribosome@gentoo.org>
+files/comp-gentoo.patch, +files/compall-gentoo.patch,
+files/compddi-gentoo.patch, +files/ddi-use-ssh-gentoo.patch,
+files/lked-gentoo.patch, +files/runall-gentoo.patch,
+files/rungms-gentoo.patch, +metadata.xml, +gamess-05272005.ebuild:
Initial import (fixes bug #105901). Package masked to allow for some
testing. Many thanks to Markus Dittrich <markusle@gmail.com> for his ebuild
and patches.
|
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