[gmx-users] Center of mass

Justin Lemkul jalemkul at vt.edu
Wed Oct 26 01:27:31 CEST 2016



On 10/25/16 7:07 PM, Mouri Ahmed wrote:
> Hi
>
> I have been looking at options for calculating center of mass distance
> between two proteins.
>
>
> If anyone has worked with the center of mass in gromacs and have notes they
> could share I'd very grateful.
>

http://manual.gromacs.org/documentation/2016/onlinehelp/gmx-distance.html
http://www.gromacs.org/Documentation/How-tos/Tool_Changes_for_5.0#g_dist

-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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