Update of the CHARMM All-Atom Additive Force Field for Lipids: Validation on Six Lipid Types

Journal of Physical Chemistry B - Tập 114 Số 23 - Trang 7830-7843 - 2010
Jeffery B. Klauda1, Richard M. Venable1, J. Alfredo Freites1, Joseph W. O’Connor1, Douglas J. Tobias1, Carlos Mondragon-Ramirez1, Igor Vorobyov1, Alexander D. MacKerell1, Richard W. Pastor1
1Department of Chemical and Biomolecular Engineering, University of Maryland, College Park, Maryland 20742, Laboratory of Computational Biology, National Heart, Lung, and Blood Institute, National Institutes of Health, Bethesda, Maryland 20892, Department of Chemistry, University of California, Irvine, California 92697-2025, and Department of Pharmaceutical Sciences, 20 Penn Street HSF II, University of Maryland, Baltimore, Maryland 21201

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