[gmx-users] Do multiple simulations in parallel

[David van der Spoel]

On Wed, 2003-07-09 at 13:26, Yuguang Mu wrote:
> In mdrun there is a switch  called -multi,
> Do multiple simulations in parallel
> What does it means ?
you can give it N topologies and it will run N simulations. Topologies
have to be called something like toplXX.tpr where XX is a sequential
nuimber from 0 upwards IIRC.

Not very useful in most cases.

> 
> Dr. Yuguang Mu
> Institute for Physical and Theoretical Chemistry
> J.W. Goethe University Frankfurt am Main
> Marie Curie Str. 11
> 60439 Frankfurt/Main, Germany
> Tel: +49-(0)69-798-29711
> 
> 
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-- 
Groeten, David.
________________________________________________________________________
Dr. David van der Spoel, 	Dept. of Cell & Mol. Biology
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://xray.bmc.uu.se/~spoel
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