[gmx-users] velocity generation
jalemkul at vt.edu
Thu Dec 5 19:29:24 CET 2013
On 12/5/13 1:21 PM, kiana moghaddam wrote:
> Dear Jastin
> Thanks your reply. as your email, I will generate velocity in NVT step with simulated annealing from 0 to 300K. What should be gen_temp value? Is 300 K correct?
This topic has been discussed repeatedly in the last few days. Please see the
Justin A. Lemkul, Ph.D.
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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