[gmx-users] Long range Lennard Jones
jalemkul at vt.edu
Thu Aug 29 23:40:43 CEST 2013
On 8/29/13 5:33 PM, Gianluca Interlandi wrote:
> And also, gromacs does not seem to use the same switching function as CHARMM.
> Has it been tested how much this affects replication of the original CHARMM MM
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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