[gmx-users] Output of g energy

[Justin Lemkul]

On 5/27/16 10:34 AM, khourshaeishargh at mech.sharif.ir wrote:
> Dear GROMACS user
> I have a question about the output of g energy. what is exactly the
> meaning of Pressure x-x ? is it the same as the stress in mechanical
> engineering or not ?!

No, it's the component of the pressure tensor along the x-axis.

-Justin

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Justin A. Lemkul, Ph.D.
Ruth L. Kirschstein NRSA Postdoctoral Fellow

Department of Pharmaceutical Sciences
School of Pharmacy
Health Sciences Facility II, Room 629
University of Maryland, Baltimore
20 Penn St.
Baltimore, MD 21201

jalemkul at outerbanks.umaryland.edu | (410) 706-7441
http://mackerell.umaryland.edu/~jalemkul

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