[gmx-users] Umbrella sampling

Justin Lemkul jalemkul at vt.edu
Sun Nov 6 13:27:36 CET 2016

On 11/6/16 1:53 AM, m g wrote:
> Dear Justin,
> In umbrella sampling tutorial, what force constant was used during the umbrella sampling simulations?

Please read the contents of the .mdp files provided in the tutorial.



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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