From: |
Jamie Platts <Platts "at@at" Cardiff.ac.uk> |
Date: |
Wed, 17 Jul 2002 10:34:47 +0100 (BST) |
Subject: |
Re: CCL:MOLVOL |
Hi Stephen - we've got the Fortran77 source for MOLVOL, which I'll send
separately. My student has also modified it to read MDL mol files, rather
than the original xyz format - would you prefer that?
Cheers,
Jamie
----------------------------------------------------------
Jamie Platts
Dept. of Chemistry Phone: +44 (0) 2920 874950
Cardiff University Email: platts \\at// cf.ac.uk
P.O. Box 912 FAX: +44 (0) 2920 874030
Cardiff CF10 3TB www.cf.ac.uk/chemy
On Tue, 16 Jul 2002, Stephen Bowlus wrote:
> Does anyone know how or from whom one can obtain the program MOLVOL by Dodd
> and Theodorou? I have been unable to locate a repository for the program,
> or Prof. Dodd, who seems to be (have been?) its curator.
>
> Thanks in advance for suggestions,
> Steve
>
> ***************************************************************
> Stephen B. Bowlus, Ph.D.
> Senior Computational Scientist
>
> LION bioscience, Inc. Stephen.Bowlus()at()lionbioscience.com
> 9880 Campus Point Dr. Phone: (858) 410-6542
> San Diego, CA 92121 Fax: (858) 410-6665
> ***************************************************************
>
>
>
>
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