On 9/9/13 6:11 PM, Rama Krishna Koppisetti wrote:
Hi Justin,
I included 1 DMPC molecule parameters in the file should I need to include
128 molecules parameters in the file .rtp.
No. Residue definitions are used any time they are encountered in the
coordinate file. There is no need for such redundancy at the force field level.
-Justin
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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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