On 11/18/13 10:40 AM, Williams Ernesto Miranda Delgado wrote:
I made a rerun on a MD simulation using Reaction-Field-zero for
electrostatics. When I analyze the *.edr file with g_energy, there appears
Coul-SR and Coul-14. How can I get the Coulomb long range term? This is
very important for making LIE calculations.

I answered this already:




Justin A. Lemkul, Ph.D.
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

jalem...@outerbanks.umaryland.edu | (410) 706-7441

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