Dear Fabio,
This is a tedious manual work explained in the manual pp111-113 FAQ 17, in
details. I am not familiar with other programs, beside Quanta, that could
create an approximately good starting residue type format. If anyone knows,
that would be helpful to share.
best wishes
Andras
Fabio Zuccotto wrote:
>
> Dear All,
>
> I'm trying to define a new ligand for inclusion in the Modeller topology
> library (top.lib). I usually generate this starting with a RTF file from
> Quanta. Unfortunately I don't have access to that program anymore. Is
> there any other way I can use to generate the appropriate topology for
> inclusion (perhaps with minor changes) into top.lib?
>
> Than you very much.
>
> Fabio
>
> *****************************
> Fabio Zuccotto, PhD
> Biological NMR Centre
> Medical Sciences Building
> University Road
> Leicester LE1 9HN
> ENGLAND (UK)
> Tel. +44 (0)116 252 3620/3071
--
,
Andras Fiser, PhD # phone: (212) 327 7206
The Rockefeller University # fax: (212) 327 7540
Box 270, 1230 York Avenue # e-mail:
New York, NY 10021-6399, USA # http://salilab.org/~andras