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# ChangeLog for sci-chemistry/webmo
# Copyright 1999-2008 Gentoo Foundation; Distributed under the GPL v2
# $Header: /var/cvsroot/gentoo-x86/sci-chemistry/webmo/ChangeLog,v 1.15 2008/02/15 08:53:27 dberkholz Exp $
*webmo-8.0.010 (15 Feb 2008)
15 Feb 2008; Donnie Berkholz <dberkholz@gentoo.org>;
+files/8.0.010-add-gamess-data-directory.patch,
+files/8.0.010-gentoo-locations.patch, +webmo-8.0.010.ebuild:
Bump.
05 Feb 2008; Benedikt Böhm <hollow@gentoo.org> webmo-6.1.010.ebuild,
webmo-7.0.003.ebuild:
merge from webapps overlay wrt #208584
03 Feb 2008; Jakub Moc <jakub@gentoo.org> webmo-6.1.010.ebuild,
webmo-7.0.003.ebuild:
Fix apache dependencies wrt Bug 208584; fix quoting, einfo -> elog
29 Jul 2007; Christian Heim <phreak@gentoo.org> webmo-6.1.010.ebuild,
webmo-7.0.003.ebuild:
Fixing the DEPEND/RDEPEND for the move of net-www/apache to
www-servers/apache (#78622).
*webmo-7.0.003 (08 May 2007)
08 May 2007; Donnie Berkholz <dberkholz@gentoo.org>;
+files/7.0.003-gentoo-locations.patch, +webmo-7.0.003.ebuild:
New features in WebMO version 7.0 include:
* Improved molecular mechanics for generating initial geometries
* Improved Editor clean-up for charged species and/or octet rule exceptions
* Automatic diagnosis and reporting of common causes of job failure
* JPEG image capture of molecular and spectral images
* Database storage of jobs and users for improved performance and scalability
* New administrative interface
* Many user interface enhancements and bug fixes
20 Sep 2006; Donnie Berkholz <dberkholz@gentoo.org>; metadata.xml:
(#148281) Change herd to sci-chemistry from sci.
05 Aug 2006; Donnie Berkholz <dberkholz@gentoo.org>; metadata.xml:
Remove myself as maintainer, anyone feel free to work on this, although I'll
continue to do so as well.
07 Jul 2006; Donnie Berkholz <dberkholz@gentoo.org>; metadata.xml:
Update to my new email address.
20 Jun 2006; Donnie Berkholz <dberkholz@gentoo.org>; webmo-6.1.010.ebuild:
Add a warning about overwriting info with etc-update.
20 Jun 2006; Donnie Berkholz <dberkholz@gentoo.org>;
-webmo-6.0.003.ebuild:
Pull old version.
*webmo-6.1.010 (20 Jun 2006)
20 Jun 2006; Donnie Berkholz <dberkholz@gentoo.org>; files/reconfig,
+webmo-6.1.010.ebuild:
Bump. Significant enhancements to reconfig script to handle webapp-config
upgrades properly via etc-update.
23 Feb 2006; Donnie Berkholz <dberkholz@gentoo.org>; webmo-6.0.003.ebuild:
Remove redundant src_compile(), reported by ciaranm.
04 Dec 2005; Donnie Berkholz <dberkholz@gentoo.org>; files/reconfig:
Don't overwrite the actual .int file, copy into ._cfg* for etc-update.
04 Dec 2005; Donnie Berkholz <dberkholz@gentoo.org>; +files/reconfig:
Add hook script, to be run when installing to live host.
04 Dec 2005; Donnie Berkholz <dberkholz@gentoo.org>;
-files/dont-be-interactive-if-root.patch,
+files/dont-be-interactive-or-diagnose.patch,
-files/dont-check-unneeded-things.patch, webmo-6.0.003.ebuild:
Turn 2 patches into a single one with 4 lines of changes.
*webmo-6.0.003 (04 Dec 2005)
04 Dec 2005; Donnie Berkholz <dberkholz@gentoo.org>;
+files/add-gamess-data-directory.patch,
+files/dont-be-interactive-if-root.patch,
+files/dont-check-unneeded-things.patch, +files/gentoo-locations.patch,
+metadata.xml, +webmo-6.0.003.ebuild:
Add a Web interface to a number of computational chemistry programs. Ones in
portage include mopac7, gamess and tinker. Also works for Gaussian, NWChem,
QChem, Molpro, etc. What needs work: reinstallations without screwing the
old configuration, and the reconfig script so editing globals.int isn't
required.
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