Re: unequal PMEGridSizes

From: Alessandro Cembran (cembran_at_chem.umn.edu)
Date: Fri Dec 29 2006 - 17:07:58 CST

Yes, that's correct.

Alessandro

Neelanjana Sengupta wrote:
> Hi NAMD users,
>
> I had a question again about PME gridsizes, used in performing
> electrostatic calculations.
> Is it OK to have unequal values for PMEGridSizeX, PMEGridSizeY and
> PMEGridSizeZ? My cellbasis vectors are roughly 51 Angs, 51 Angs and 60
> Angs, and I have corresponding PMEGridsizes of 54, 54 and 64
> respectively..
>
> Wishing everybody a wonderful new year!
> Regards,
> --
> ****************************************
> Neelanjana Sengupta, PhD student
> Dept. of Chemistry
> Univ. of California-Irvine
> Irvine, CA 92697
> USA
> Phone: 1-949-824 9921
> email: sengupta_at_uci.edu <mailto:sengupta_at_uci.edu>
> ****************************************

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