[gmx-users] Flying ice cube

[David van der Spoel]

On Mon, 2005-01-31 at 14:31 -0300, lpgomes at fiocruz.br wrote:
> Hi everybody,
> 
> Does anyone knows if PME have correction for this problem (the
> flying ice cube)?

It has nothing to do with PME. If you want you can remove center of mass
motion, which is useful mainly in vacuum, but then you don't usually use
PME anyway.

> 
> Regards,
> 
> Luciano
> Instituto de Química
> University of Brasilia - Brazil
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-- 
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://xray.bmc.uu.se/~spoel
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