Re: [AMBER] How to obtain the pressure in NVT ensemble

From: Bill Ross <ross.cgl.ucsf.edu>
Date: Tue, 22 Oct 2019 00:44:00 -0700

Is the Virial mentioned in the output? I think it was there tho can't
explain the difference.

Bill

On 10/21/19 11:37 PM, jinfeng liu wrote:
> Dear Amber users,
>
>
> I want to know the pressure in the NVT ensemble. How can I obtain
> the pressure in the NVT ensemble ?
>
> Thanks in advance.
>
> Best,
> Jinfeng
> _______________________________________________
> AMBER mailing list
> AMBER.ambermd.org
> http://lists.ambermd.org/mailman/listinfo/amber

_______________________________________________
AMBER mailing list
AMBER.ambermd.org
http://lists.ambermd.org/mailman/listinfo/amber
Received on Tue Oct 22 2019 - 01:00:03 PDT
Custom Search