Re: Re: Colvar on 2.7b2 win vs Linux MPI instalation

From: Axel Kohlmeyer (akohlmey_at_gmail.com)
Date: Tue Feb 09 2010 - 16:01:44 CST

On Tue, 2010-02-09 at 22:15 +0100, Branko wrote:
> Sorry for very late respond, but we have other (subjective :-) )
> problems with MPI compilation. I could not guaranteed, but most likely
> that conversion tool solve the problem. One more question Are
> using of colvars slow down 2.7b2 when job is executing on MPI, is
> there any problem with "parallelization"? Any advise is highly
> appreciated.

branko,

check out the scaling graph at:
http://www.temple.edu/cst/icms/software.html#colvars

are you certain that the parallelization issues *only*
show up with colvars enabled?

cheers,
   axel.

>
> Sincerely
>
> Branko
>

-- 
Dr. Axel Kohlmeyer  akohlmey_at_gmail.com
http://sites.google.com/site/akohlmey/
Institute for Computational Molecular Science
Temple University, Philadelphia PA, USA.

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