On 9/17/14 7:01 AM, h.aliza...@znu.ac.ir wrote:
Dear GROMACS users,
Is it possible to track H-bonding or distance between two certain atoms in
GROMACS?
Of course. See Chapter 8 for available analysis tools. There are several
designed to do exactly what you want.
-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
jalem...@outerbanks.umaryland.edu | (410) 706-7441
http://mackerell.umaryland.edu/~jalemkul
==
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