Hi David,
Thank you for your email.
Best regards,
Rui
On Sat, Dec 14, 2019 at 7:48 AM David Case <david.case.rutgers.edu> wrote:
> On Fri, Dec 13, 2019, Rui Chen wrote:
> >
> >I have a follow-up question. In order to run MM-GBSA, I removed all the
> >waters and ions, which made the system net charge not zero (-16.000). How
> >can I solve this problem?
>
> This is not a problem: it is what is expected for this sort of
> calculation.
>
> ....dac
>
>
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Received on Wed Dec 18 2019 - 09:30:02 PST
