[gmx-users] NMA in vaccum or water?

[Ruben Martinez Buey]

> Hi David,

Thanks al ot for your reply,

>
> >
> > OK, but how can I do that (a water shell with 1-2 layers of water molecules (and
> > internal waters))?
>
> genbox -shell XXX
>

Have I to generate a box previously with editconf??
If I want only an external layer of water, what value for XXX should I enter?
Thanks in advance,
with best wishes
Ruben