On Mon, Apr 18, 2011, MD wrote:
> I'd like to add ions to water, using the following command,
>
> a= SPCBOX
> I want the ions randomly packed in the water box, how can i achieve this purpose?
The recommended approach is to choose a single water molecule as the "solute",
then use solvateBox and addIons to prepare the simulation.
....good luck...dac
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Received on Mon Apr 18 2011 - 05:30:03 PDT
