[gmx-users] aMD for Gromacs?
jalemkul at vt.edu
Tue Feb 25 19:32:59 CET 2014
On 2/25/14, 1:03 PM, Albert wrote:
> Does anybody knows can we do Accelerated molecular dynamics (aMD, developed in
> Mccammon group) in Gromacs? I seldom
> see someone did this in Gromacs....
Gromacs has flooding, which I think is similar. But as far as aMD, no.
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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