center of mass with gibbs ?

From: Terreux Raphael <terreux_at_taloa.unice.fr>
Date: Mon 29 May 2000 15:46:12 -0700

Dear amber users,

 I would try to use internal constraint in gibbs module based on the
center of mass.
On the manual of amber 5 and 6, it is explain how to define the center
of mass, and applied constraint on it with sander.

Does it possible to use it with Gibbs ?


Best regards.

Raphael terreux


--
-------------------------------------------------------
TERREUX Raphael
Laboratoire A.S.I Equipe Chimiometrie Modelisation
Universite de Nice-Sophia Antipolis,
Parc Valrose, F 06108, Cedex 2,
NICE, FRANCE
TEL : +33 (0)4 92 07 61 26
FAX : +33 (0)4 92 07 61 25
e-mail : terreux_at_chiminfo.unice.fr
         terreux_at_unice.fr
web    : http://chiminfo11.unice.fr/~terreux/index.htm
-------------------------------------------------------
Received on Mon May 29 2000 - 15:46:12 PDT
Custom Search