[gmx-users] about PME

[Alan Wilter Sousa da Silva]

Thank you Dr. der Spoel.

I checked darden93 and I wasn't able to find a clear answer like you gave
me.

On 17 Jan 2003, David van der Spoel wrote:

> > 	I'm just trying to wonder how PME works.  The procedure of
> > assigning charges to the interpolated grid is done at every step of MD,
> > isn't it?
> >
> yes.
>
> it is described in the essman95 and darden93 papers. It's quite complex
> math...

Cheers,

-----------------------
Alan Wilter S. da Silva
-----------------------
 Laboratório de Física Biológica
  Instituto de Biofísica Carlos Chagas Filho
   Universidade do Brasil/UFRJ
    Rio de Janeiro, Brasil