[gmx-users] Dihedral restraint in explicit water
jalemkul at vt.edu
Sat Mar 18 13:04:19 CET 2017
On 3/18/17 6:27 AM, Anurag Kumar wrote:
> Dear all,
> Restraining dihedral for dipeptide in explicit water model, how it can be
There are lots of threads in the archive about this (Google is your friend) as
well as relevant topology and .mdp options in the manual.
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
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