[gmx-users] Can I use more memory to speed up computa tion?

David van der Spoel spoel at xray.bmc.uu.se
Tue Dec 26 16:07:12 CET 2006

intelandamd wrote:
> Dear all
>     There are 1024MB memory available in my computer and I want to use 
> more memory than default to speed up computation.Can I do that and what 
> command should I use? Thank you!
>     Kind Regards
>                                                         Yours
>                                                             Yang
>  No you can't. You can do this in quantum chemistry to avoid 
recomputation of the same result, but gromacs never computes the same 
thing twice.

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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