From N.Haggett[ AT ]surrey.ac.uk Mon May 11 08:30:17 1998 Received: from mailc.surrey.ac.uk for N.Haggett $#at#$ surrey.ac.uk by www.ccl.net (8.8.3/950822.1) id IAA03598; Mon, 11 May 1998 08:25:43 -0400 (EDT) Message-Id: <199805111225.IAA03598 "-at-" www.ccl.net> Received: from surrey.ac.uk by mailc.surrey.ac.uk id <28330-0 _-at-_)mailc.surrey.ac.uk>; Mon, 11 May 1998 13:24:59 +0100 Subject: Use of AMBER modelling software To: chemistry-: at :-www.ccl.net Date: Mon, 11 May 1998 13:24:58 +0100 (BST) X-Mailer: ELM [version 2.4 PL25] MIME-Version: 1.0 Content-Type: text/plain; charset=US-ASCII Content-Transfer-Encoding: 7bit From: Mr Nicholas MW Haggett Sender: N.Haggett _-at-_)surrey.ac.uk Dear CCL users I am trying to use the text-based version of AMBER 5 on a dec-alpha machine (Digital UNIX V4.0B), Rutherford Appleton Laboratory, UK. I am studying carbohydrates and the residues I need are not supplied, so I am trying to enter them manually, using the 'prep' and 'link' programs. The two sugars i need are alpha - L - anhydrogalactose and beta - D - galactose. The program does not seem to connect them up correctly after I have run 'prep' and 'link' on a five - sugar ring chain. If anyone uses this software and these residues (or related sugars) please could they get in touch with me. It would be most helpful if I could see samples residue input file for these sugars. Nicholas Haggett, University of Surrey, Guildford, UK email: chp1nh -A_T- surrey.ac.uk Tel.: (01483) 259591 ______________________________________________________________________