[gmx-users] carbon nanotube - ifnite in length ?
jalemkul at vt.edu
Thu Oct 10 15:55:03 CEST 2013
On 10/10/13 9:53 AM, Steven Neumann wrote:
> Thank you. Would both be equal in terms of gaining computational time?
No idea. You definitely would not gain anything from using the [nonbond_params]
approach. Maybe with exclusions.
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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