[gmx-users] REMD in parallel

[David van der Spoel]

Andrey V. Golovin wrote:
> Dear All,
> We curious about the possibility to run REMD  4 replicas on for instance 
> 8 or 16 processors. Up to this moment it's looks like only single node 
> tpr could be used. Is it true?
> Thanks in advance.
> 
> P.S. We are using 3.3.1 version of Gromacs.
> 
this is implemented in the CVS version of gromacs, that is the 4.0alpha 
(i.e. not even beta). Please try at your own risk.

-- 
David.
________________________________________________________________________
David van der Spoel, PhD, Assoc. Prof., Molecular Biophysics group,
Dept. of Cell and Molecular Biology, Uppsala University.
Husargatan 3, Box 596,  	75124 Uppsala, Sweden
phone:	46 18 471 4205		fax: 46 18 511 755
spoel at xray.bmc.uu.se	spoel at gromacs.org   http://folding.bmc.uu.se
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