The system has 2668 atoms. The first atom is Mg2+ and the following 18
atoms belong to the water molecules of the complex. The rest of them are
all solvent water molecules.
On Mon, May 17, 2010 at 1:05 PM, Bill Ross <ross.cgl.ucsf.edu> wrote:
> > Density = 0.6778
>
> It would be interesting to see if vlimit would be exceeded if density
> was equilibrated. How many atoms in this system? It may be not enough
> to create a stable box.
>
> Bill
>
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--
Best,
InSuk Joung
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Received on Mon May 17 2010 - 11:00:10 PDT
