[MMTK] Re: coordinates

Konrad Hinsen hinsen@cnrs-orleans.fr
Mon, 25 Nov 2002 20:15:24 +0100


> i have heard about steepest distance and conjugate method.
> can u please give me the refernec where i can read method and how to
> implement them in detail.

Both methods are implemented in MMTK, see the manual for details.
In most cases, the best combination is to start with steepest gradient
and then switch to conjugate gradient near the minimum.
-- 
-------------------------------------------------------------------------------
Konrad Hinsen                            | E-Mail: hinsen@cnrs-orleans.fr
Centre de Biophysique Moleculaire (CNRS) | Tel.: +33-2.38.25.56.24
Rue Charles Sadron                       | Fax:  +33-2.38.63.15.17
45071 Orleans Cedex 2                    | Deutsch/Esperanto/English/
France                                   | Nederlands/Francais
-------------------------------------------------------------------------------