[gmx-users] electron density by gmx density
Justin Lemkul
jalemkul at vt.edu
Thu Jul 14 12:15:45 CEST 2016
On 7/14/16 6:27 AM, amitbehra at chemeng.iisc.ernet.in wrote:
> Hello Users,
> I was wandering how can we calculate the electron density with the help of
> gmx density. how to write the " -ei [<.dat>] (electrons.dat) "
>
There is an example in the help information.
-Justin
--
==================================================
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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