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327 lines
12 KiB
327 lines
12 KiB
# ChangeLog for sci-chemistry/gamess
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# Copyright 1999-2013 Gentoo Foundation; Distributed under the GPL v2
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# $Header: /var/cvsroot/gentoo-x86/sci-chemistry/gamess/ChangeLog,v 1.59 2013/02/27 16:50:41 jlec Exp $
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27 Feb 2013; Justin Lecher <jlec@gentoo.org> gamess-20110811.1.ebuild,
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files/gamess-20110811.1.gentoo.patch, metadata.xml:
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Use PKG_CONFIG instead of generic pkg-config
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19 Oct 2012; Justin Lecher <jlec@gentoo.org> gamess-20110811.1.ebuild,
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metadata.xml:
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Remove virtual/fortran and always call fortran-2_pkg_setup as intend by the
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updated fortran-2.eclass
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04 May 2012; Jeff Horelick <jdhore@gentoo.org> gamess-20110811.1.ebuild:
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dev-util/pkgconfig -> virtual/pkgconfig
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*gamess-20110811.1 (13 Oct 2011)
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13 Oct 2011; Alexey Shvetsov <alexxy@gentoo.org>
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-gamess-20101001.3-r1.ebuild, -files/gamess-20101001.3.gentoo.patch,
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+gamess-20110811.1.ebuild, +files/gamess-20110811.1.gentoo.patch,
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-files/gamess-neo-fix.patch, files/gamess-checktst.patch, metadata.xml:
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Version bump. Fixed bugs #375803 #386839
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08 Oct 2011; Alexey Shvetsov <alexxy@gentoo.org> gamess-20101001.3-r1.ebuild:
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Fix patch name
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*gamess-20101001.3-r1 (06 Oct 2011)
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06 Oct 2011; Alexey Shvetsov <alexxy@gentoo.org> -gamess-20101001.3.ebuild,
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+gamess-20101001.3-r1.ebuild, +files/gamess-checktst.patch:
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Fix bug #379973. Thanks to Florian D.
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20 Jul 2011; Pacho Ramos <pacho@gentoo.org> metadata.xml:
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Drop maintainer due retirement, bug #105599
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21 Jun 2011; Justin Lecher <jlec@gentoo.org> gamess-20101001.3.ebuild:
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Add dependency on virtual/fortran
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21 Jun 2011; Justin Lecher <jlec@gentoo.org> gamess-20101001.3.ebuild:
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Added fortran-2.eclass support
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*gamess-20101001.3 (17 Jun 2011)
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17 Jun 2011; Alexey Shvetsov <alexxy@gentoo.org>
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-gamess-20101001.1-r1.ebuild, -files/gamess-20101001.1.gentoo.patch,
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+gamess-20101001.3.ebuild, +files/gamess-20101001.3.gentoo.patch:
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Version bump. Thanks to Wilhelm Eger
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*gamess-20101001.1-r1 (23 Jan 2011)
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23 Jan 2011; Alexey Shvetsov <alexxy@gentoo.org> -gamess-20101001.1.ebuild,
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+gamess-20101001.1-r1.ebuild, +files/gamess-neo-fix.patch:
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Fix neo build for gamess
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29 Dec 2010; Alexey Shvetsov <alexxy@gentoo.org>
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-gamess-20090112.1-r1.ebuild, -files/gamess-20090112.1.gentoo.patch,
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gamess-20101001.1.ebuild:
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Fix gamess build. Aslo remove old versions since upstream provides only
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latest tarball
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20 Dec 2010; Justin Lecher <jlec@gentoo.org> gamess-20090112.1-r1.ebuild,
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gamess-20101001.1.ebuild:
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Fix for fortran detection, thanks alexxy noting this
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16 Dec 2010; Justin Lecher <jlec@gentoo.org> gamess-20090112.1-r1.ebuild,
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gamess-20101001.1.ebuild:
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Removal of fortran.eclass, #348851
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08 Dec 2010; Alexey Shvetsov <alexxy@gentoo.org> gamess-20101001.1.ebuild:
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Fix neo code
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07 Dec 2010; Alexey Shvetsov <alexxy@gentoo.org> gamess-20101001.1.ebuild,
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+files/gamess-qmmm-tinker-fix-idate.patch, metadata.xml:
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Make neo optional also fix qmmm compilation
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*gamess-20101001.1 (07 Dec 2010)
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07 Dec 2010; Alexey Shvetsov <alexxy@gentoo.org> -gamess-20080411.1.ebuild,
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-files/gamess-20080411.1.gentoo.patch, -gamess-20090112.1.ebuild,
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-gamess-20090112.3.ebuild, -gamess-20090112.3-r1.ebuild,
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-gamess-20100325.2.ebuild, -files/gamess-20100325.2.gentoo.patch,
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+gamess-20101001.1.ebuild, +files/gamess-20101001.1.gentoo.patch:
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Add new gamess release. Clean up old ones. TODO: Add cuda support and fix
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broken mpi stuff
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12 Aug 2010; Kacper Kowalik <xarthisius@gentoo.org>
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gamess-20100325.2.ebuild:
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Add missing depend on dev-util/pkgconfig wrt bug 332439. Thanks to Malcolm
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Galland <MalcolmGalland@letu.edu> for reporting.
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30 May 2010; Alexey Shvetsov <alexxy@gentoo.org> gamess-20100325.2.ebuild,
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+files/gamess-20100325.2.gentoo.patch:
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make it build with new buildsystem
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*gamess-20100325.2 (24 May 2010)
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24 May 2010; Alexey Shvetsov <alexxy@gentoo.org>
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+gamess-20100325.2.ebuild:
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Version bump with improved qmmm stuff
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30 Nov 2009; Alexey Shvetsov <alexxy@gentoo.org>
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gamess-20090112.3-r1.ebuild:
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Fix typo
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*gamess-20090112.3-r1 (30 Nov 2009)
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30 Nov 2009; Alexey Shvetsov <alexxy@gentoo.org>
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+gamess-20090112.3-r1.ebuild:
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Enable mpi build for gamess-us
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07 Nov 2009; Mounir Lamouri <volkmar@gentoo.org>
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gamess-20090112.1-r1.ebuild:
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Stable on ppc, bug 268848
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*gamess-20090112.3 (23 Oct 2009)
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23 Oct 2009; Markus Dittrich <markusle@gentoo.org>
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-gamess-20070324.1.ebuild, -files/gamess-20070324.1.gentoo.patch,
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-gamess-20070324.3.ebuild, -files/gamess-20070324.3.gentoo.patch,
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-gamess-20070324.6.ebuild, +gamess-20090112.3.ebuild:
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Version bump and removed old ebuilds.
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07 Jul 2009; Diego E. Pettenò <flameeyes@gentoo.org>
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gamess-20090112.1-r1.ebuild:
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Use elog for fetch error.
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23 May 2009; Markus Meier <maekke@gentoo.org> gamess-20090112.1-r1.ebuild:
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amd64 stable, bug #268848
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15 May 2009; Christian Faulhammer <fauli@gentoo.org>
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gamess-20090112.1-r1.ebuild:
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stable x86, bug 268848
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23 Apr 2009; Alexey Shvetsov <alexxy@gentoo.org> gamess-20090112.1-r1:
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Add support of adjusting MM size at build time
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*gamess-20090112.1-r1 (22 Apr 2009)
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22 Apr 2009; Alexey Shvetsov <alexxy@gentoo.org> metadata.xml,
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+gamess-20090112.1-r1.ebuild:
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Add QM/MM support to GAMESS-US
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*gamess-20090112.1 (20 Feb 2009)
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20 Feb 2009; Alexey Shvetsov <alexxy@gentoo.org>
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+files/gamess-20090112.1.gentoo.patch, metadata.xml,
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+gamess-20090112.1.ebuild:
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Version bump (bug #258062). Add myself to metadata.xml
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12 Oct 2008; Markus Dittrich <markusle@gentoo.org>
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files/gamess-20080411.1.gentoo.patch:
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Made slight change to rungms script to allow parallel runs via
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environmental variables (see bug #241394). Thanks much to Alexey
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Shvetsov <alexxyum@gmail.com> for the suggestion.
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29 Jun 2008; Torsten Veller <tove@gentoo.org> gamess-20070324.1.ebuild,
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gamess-20070324.3.ebuild, gamess-20070324.6.ebuild,
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gamess-20080411.1.ebuild:
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Add missing die: || "..." -> || die "..."
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11 May 2008; Christian Faulhammer <opfer@gentoo.org>
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gamess-20070324.1.ebuild:
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revert stable KEYWORDS because the tarball is restricted and old ones won't
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be available from upstream. Requested by markusle by mail
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10 May 2008; Markus Dittrich <markusle@gentoo.org>
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+gamess-20070324.1.ebuild:
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Re-added accidentally removed stable version.
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*gamess-20080411.1 (08 May 2008)
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08 May 2008; Markus Dittrich <markusle@gentoo.org>
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-files/gamess-20060907.4.gentoo.patch,
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-files/gamess-20070324.1.gentoo.patch,
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+files/gamess-20080411.1.gentoo.patch, -gamess-20060907.4.ebuild,
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-gamess-20070324.1.ebuild, +gamess-20080411.1.ebuild:
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Version bump (fixes bug #220855).
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*gamess-20070324.6 (18 Mar 2008)
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18 Mar 2008; Markus Dittrich <markusle@gentoo.org>
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+gamess-20070324.6.ebuild:
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Version bump.
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*gamess-20070324.3 (27 Oct 2007)
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27 Oct 2007; Markus Dittrich <markusle@gentoo.org>
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+files/gamess-20070324.3.gentoo.patch, +gamess-20070324.3.ebuild:
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Version bump and keyworded gamess for amd64.
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An external blas library is now mandatory.
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19 Aug 2007; Markus Dittrich <markusle@gentoo.org>
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gamess-20070324.1.ebuild:
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Fixed bad RDEPEND.
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03 Jul 2007; Christian Faulhammer <opfer@gentoo.org>
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gamess-20070324.1.ebuild:
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stable x86, bug 183881
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*gamess-20070324.1 (17 Apr 2007)
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17 Apr 2007; Markus Dittrich <markusle@gentoo.org>
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-files/gamess-glibc-2.4-gentoo.patch, -files/comp-lked-20060222.2.patch,
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-files/rungms-runall-20060222.2.patch,
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-files/gamess-20060222.5.gentoo.patch,
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+files/gamess-20070324.1.gentoo.patch, -files/ddi-use-ssh-gentoo.patch,
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+gamess-20070324.1.ebuild:
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Version bump and cleaned up unused patches.
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07 Jan 2007; Danny van Dyk <kugelfang@gentoo.org>
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-gamess-20060222.2.ebuild, -gamess-20060222.5.ebuild:
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QA: Removed unused versions.
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*gamess-20060907.4 (14 Dec 2006)
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14 Dec 2006; Markus Dittrich <markusle@gentoo.org>
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+files/gamess-20060907.4.gentoo.patch, +gamess-20060907.4.ebuild:
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Version bump. This version includes the NEO code.
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*gamess-20060222.5 (26 Sep 2006)
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26 Sep 2006; Markus Dittrich <markusle@gentoo.org>
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+files/gamess-20060222.5.gentoo.patch, -files/comp-gentoo.patch,
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-files/compall-gentoo.patch, -files/compddi-gentoo.patch,
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-files/lked-gentoo.patch, -files/runall-gentoo.1.patch,
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-files/rungms-gentoo.1.patch, -gamess-05272005.5.ebuild,
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+gamess-20060222.5.ebuild:
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Version bump (see bug #149118). Also removed one old ebuild and
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its accompanying files.
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20 Sep 2006; Donnie Berkholz <dberkholz@gentoo.org>; metadata.xml:
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(#148281) Change herd to sci-chemistry from sci.
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30 Jun 2006; Markus Dittrich <markusle@gentoo.org>
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gamess-20060222.2.ebuild:
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Changed the ebuild to provide the test scripts used to validate
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the gamess test runs. This fixes bug #138516.
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23 Jun 2006; Markus Dittrich <markusle@gentoo.org>
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gamess-20060222.2.ebuild:
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Disable linking against external blas when compiling with ifc and
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print out a warning.
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23 May 2006; Markus Dittrich <markusle@gentoo.org>
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gamess-20060222.2.ebuild:
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Removed ifc use flag and replaced it with fortran.eclass logic.
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14 May 2006; Donnie Berkholz <spyderous@gentoo.org>;
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gamess-05272005.5.ebuild, gamess-20060222.2.ebuild:
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Convert leading spaces to tabs.
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14 May 2006; Donnie Berkholz <spyderous@gentoo.org>;
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gamess-20060222.2.ebuild:
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Keyword ~ppc. Also make sure to strip -malign-double on non-x86 systems.
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28 Mar 2006; Markus Dittrich <markusle@gentoo.org>
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+files/gamess-glibc-2.4-gentoo.patch, gamess-20060222.2.ebuild:
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Added patch to fix missing CLK_TCK with glibc-2.4. Thanks to
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Jaroslaw Kalinowski <jak137@o2.pl> for pointing this out. This
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fixes bug #127784.
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*gamess-20060222.2 (22 Mar 2006)
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22 Mar 2006; Markus Dittrich <markusle@gentoo.org>
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+files/comp-lked-20060222.2.patch, +files/rungms-runall-20060222.2.patch,
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-files/comp-gentoo.1.patch, -files/runall-gentoo.patch,
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-files/rungms-gentoo.patch, -gamess-05272005.3.ebuild,
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-gamess-05272005.3-r1.ebuild, -gamess-05272005.3-r2.ebuild,
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+gamess-20060222.2.ebuild:
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Version bump and changed the ebuild naming convention to start with
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the year since otherwise portage can't properly keep track of
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updates. Also removed obsolete ebuilds/patches. gcc-4.1 currently
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generates bad binaries even with very conservative compile flags.
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08 Feb 2006; Markus Dittrich <markusle@gentoo.org>
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gamess-05272005.5.ebuild:
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Made ebuild ready to compile and run properly using gfortran.
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23 Jan 2006; Markus Dittrich <markusle@gentoo.org>
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files/digest-gamess-05272005.5, Manifest:
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Fixed improper digest. This resolves bug #119994.
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*gamess-05272005.5 (20 Jan 2006)
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20 Jan 2006; Markus Dittrich <markusle@gentoo.org>
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+gamess-05272005.5.ebuild:
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Bump to latest revision 27 JUN 2005 (R5).
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*gamess-05272005.3-r2 (07 Dec 2005)
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07 Dec 2005; Markus Dittrich <markusle@gentoo.org>
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+files/comp-gentoo.1.patch, +gamess-05272005.3-r2.ebuild:
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This revision has the TDHF code enabled, which should now work properly with
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the patched g77 (see bug #114367).
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*gamess-05272005.3-r1 (04 Dec 2005)
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04 Dec 2005; Markus Dittrich <markusle@gentoo.org>
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+files/runall-gentoo.1.patch, +files/rungms-gentoo.1.patch,
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+gamess-05272005.3-r1.ebuild:
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This new revision installs the rungms wrapper into /usr/bin to avoid that
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users have to copy it manually and to play well with WebMO.
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*gamess-05272005.3 (03 Dec 2005)
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03 Dec 2005; Markus Dittrich <markusle@gentoo.org>
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files/rungms-gentoo.patch, -gamess-05272005.ebuild,
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+gamess-05272005.3.ebuild:
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Bumped GAMESS to most recent version and changed ebuild naming to properly
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reflect the revision number; this fixes bug #114278. Removed old ebuild.
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08 Nov 2005; Markus Dittrich <markusle@gentoo.org> ChangeLog:
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marked gamess-05272005.ebuild as ~x86
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*gamess-05272005 (20 Sep 2005)
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20 Sep 2005; Olivier Fisette <ribosome@gentoo.org>
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+files/comp-gentoo.patch, +files/compall-gentoo.patch,
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+files/compddi-gentoo.patch, +files/ddi-use-ssh-gentoo.patch,
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+files/lked-gentoo.patch, +files/runall-gentoo.patch,
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+files/rungms-gentoo.patch, +metadata.xml, +gamess-05272005.ebuild:
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Initial import (fixes bug #105901). Package masked to allow for some
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testing. Many thanks to Markus Dittrich <markusle@gmail.com> for his ebuild
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and patches.
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