From mboxrd@z Thu Jan 1 00:00:00 1970 Received: from lists.gentoo.org ([140.105.134.102] helo=robin.gentoo.org) by nuthatch.gentoo.org with esmtp (Exim 4.54) id 1F7DGP-0000ds-0v for garchives@archives.gentoo.org; Thu, 09 Feb 2006 14:59:17 +0000 Received: from robin.gentoo.org (localhost [127.0.0.1]) by robin.gentoo.org (8.13.5/8.13.5) with SMTP id k19Ewa6O009412; Thu, 9 Feb 2006 14:58:36 GMT Received: from smtp.gentoo.org (smtp.gentoo.org [134.68.220.30]) by robin.gentoo.org (8.13.5/8.13.5) with ESMTP id k19EwZhH027504 for ; Thu, 9 Feb 2006 14:58:36 GMT Received: from markusle (helo=localhost) by smtp.gentoo.org with local-esmtp (Exim 4.54) id 1F7DFj-00066T-K8 for gentoo-science@lists.gentoo.org; Thu, 09 Feb 2006 14:58:35 +0000 Date: Thu, 9 Feb 2006 14:58:33 +0000 (UTC) From: Markus Dittrich To: gentoo-science@lists.gentoo.org Subject: Re: [gentoo-science] gamess gui's In-Reply-To: <43EAD010.2010608@gentoo.org> Message-ID: References: <43EAD010.2010608@gentoo.org> Precedence: bulk List-Post: List-Help: List-Unsubscribe: List-Subscribe: List-Id: Gentoo Linux mail X-BeenThere: gentoo-science@gentoo.org Reply-to: gentoo-science@lists.gentoo.org MIME-Version: 1.0 Content-Type: TEXT/PLAIN; charset=US-ASCII X-Archives-Salt: 8bc77c87-8692-441c-95d6-aa55a501b8dd X-Archives-Hash: 3bcf28a6790bb1c79cc63f0b7d7f8536 -----BEGIN PGP SIGNED MESSAGE----- Hash: SHA1 On Wed, 8 Feb 2006, Donnie Berkholz wrote: > Hi, > > What GUIs do you know of for GAMESS? I came across The upcoming release of VMD (1.8.4) http://www.ks.uiuc.edu/Development/Download/download.cgi?PackageName=VMD will feature a GAMESS plugin that has the ability to read GAMESS log files and display the geometry/trajectories. The functionality is pretty basic at the moment but still fairly usable. Planned features include the display of orbitals and a separate GUI to set up runs, etc... BTW: The current stable release of VMD (1.8.3) should hit portage today/tomorrow for testing. best, Markus - -- Markus Dittrich (markusle) Gentoo Linux Developer Scientific applications -----BEGIN PGP SIGNATURE----- Version: GnuPG v1.4.2 (GNU/Linux) iD8DBQFD61ibxlRwCwb7k40RAtMvAJ9vdpHa7DFk89CbBhfP5zIBTzsxNACffIKr ffZCvPWFgxHypwZ6O+SzyLY= =CYfC -----END PGP SIGNATURE----- -- gentoo-science@gentoo.org mailing list