[gmx-users] radial density profile
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 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
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