[gmx-users] radial density profile

Justin Lemkul jalemkul at vt.edu
Tue Aug 19 15:13:08 CEST 2014



On 8/19/14, 9:02 AM, Atila Petrosian wrote:
> Dear Justin
>
> Thanks for your quick answer.
>
> I want to obtain *radial density profile* relative to COM and not radial
> distribution function (RDF) relative to COM.
>
> Are you sure g_rdf -com is appropriate for this aim?
>

Sorry, misread.  gmx density (note, the 5.0 version) should have options to do 
what you need.

-Justin

-- 
==================================================

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

Department of Pharmaceutical Sciences
School of Pharmacy
Health Sciences Facility II, Room 601
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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