From chemistry-request %-% at %-% server.ccl.net Mon Mar 31 09:49:06 2003 Received: from anor.ics.muni.cz ([147.251.4.35]) by server.ccl.net (8.11.6/8.11.0) with ESMTP id h2VEn5s12225 for ; Mon, 31 Mar 2003 09:49:05 -0500 Received: from bilbo.chemi.muni.cz (bilbo.chemi.muni.cz [147.251.28.2]) by anor.ics.muni.cz (8.12.1/8.12.1) with ESMTP id h2VEn0hT005337 (version=TLSv1/SSLv3 cipher=EDH-RSA-DES-CBC3-SHA bits=168 verify=NO) for ; Mon, 31 Mar 2003 16:49:00 +0200 Received: from pegas (pegas.chemi.muni.cz [147.251.28.96]) by bilbo.chemi.muni.cz (8.11.6/8.8.5) with SMTP id h2VEn0J11107 for ; Mon, 31 Mar 2003 16:49:00 +0200 (MEST) Message-ID: <004a01c2f795$9c9ce170$601cfb93 /at\chemi.muni.cz> From: "TRITON" To: Subject: New Version of TRITON 3.0 Released Date: Mon, 31 Mar 2003 16:55:46 +0200 MIME-Version: 1.0 Content-Type: text/plain; charset="iso-8859-2" Content-Transfer-Encoding: 7bit X-Priority: 3 X-MSMail-Priority: Normal X-Mailer: Microsoft Outlook Express 5.50.4522.1200 X-MIMEOLE: Produced By Microsoft MimeOLE V5.50.4910.0300 X-Muni-Virus-Test: Clean Dear CCLers: We are pleased to announce the official release of new 3.0 version of program TRITON. Program TRITON 3.0 is graphic software package for: - in silico construction of protein mutants by homology modelling using the external program MODELLER - modelling of enzymatic reactions using semi-empirical quantum-mechanic method of external program MOPAC - analysis of essential electrostatic interactions between enzyme amino acids and substrate using results from previous calculations. TRITON 3.0 provides integrated graphic interface and tools for: - preparation of the input data files - automatic running calculations and their monitoring - visualization and graphical analysis of the output data. Program TRITON 3.0 is being developed in the National Centre for Biomolecular Research, Masaryk University, Brno, Czech Republic and is provided free of charge to academic users. Current version is available for IRIX, Linux or NetBSD platforms. Program TRITON 3.0 is suitable tool not only for molecular biologists and biochemists, non-specialists in computer modeling, but it can be also found as interesting and useful tool for computational chemists. For more information concerning this program and for download of the program please visit TRITON 3.0 official web site at http://ncbr.chemi.muni.cz/triton/triton.html. New in version 3.0 http://ncbr.chemi.muni.cz/triton/triton.html#newinversion30 TRITON Development Team