[gmx-users] System has non-zero total charge: -8.000001e+00

Tamas Horvath hotafin at gmail.com
Thu Feb 25 13:53:50 CET 2010


You should always neutralise your sysem.

On Thu, Feb 25, 2010 at 1:42 PM, Maurício Menegatti Rigo <
mauriciomr1985 at gmail.com> wrote:

> IS this a problem?
>
> *System has non-zero total charge: -8.000001e+00*
>
> If yes, can I fix that changing COulomb cutt-off to PME electrostatics?
>
> THanks!!
>
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