From chemistry-request /at\server.ccl.net Tue May 21 09:08:47 2002 Received: from soul.helsinki.fi ([128.214.3.1]) by server.ccl.net (8.11.6/8.11.0) with ESMTP id g4LD8k124308 for ; Tue, 21 May 2002 09:08:46 -0400 Received: from localhost (mpjohans&$at$&localhost) by soul.helsinki.fi (8.9.3/8.9.3) with ESMTP id QAA07487; Tue, 21 May 2002 16:08:40 +0300 (EET DST) X-Authentication-Warning: soul.helsinki.fi: mpjohans owned process doing -bs Date: Tue, 21 May 2002 16:08:40 +0300 (EET DST) From: Mikael Johansson X-Sender: To: amor san juan cc: Subject: Re: CCL:mol2 file format In-Reply-To: <20020521004528.33455.qmail: at :web12807.mail.yahoo.com> Message-ID: MIME-Version: 1.0 Content-Type: TEXT/PLAIN; charset=US-ASCII Hello Amor and All! On Mon, 20 May 2002, amor san juan wrote: > Would someone please forward me the Sybyl mol2 file > format description. Im having hard time figuring out > in justifying the result I got in ben.pdbq which is > different in data coordinates file of benA.pdbq > sourced from file example distribution in AutoDock3. You can (surprisingly ;-) find it at the Tripos home page: http://www.tripos.com/services/mol2/ Have a nice day, Mikael Johansson University of Helsinki Department of Chemistry mikael.johansson- at -helsinki.fi http://www.helsinki.fi/~mpjohans/ Phone: +358-9-191 50185 FAX : +358-9-191 50169