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Active-site dynamics in protein molecules - a stochastic boundary molecular-dynamics approach, , and . Biopolymers, 24 (5): 843--865 (1985)Solvent effects on protein motion and protein effects on solvent motion - dynamics of the active-site region of lysozyme, and . J. Mol. Biol., 208 (1): 159--181 (1989)Improved Treatment of the Protein Backbone in Empirical Force Fields, , and . J. Am. Chem. Soc., 126 (3): 698--699 (January 2004)Mechanics of bacteriophage maturation, , , , , and . Proc Natl Acad Sci U S A, 109 (7): 2342-2347 (February 2012)CHARMM: The biomolecular simulation program, , , , , , , , , and 25 other author(s). Journal of Computational Chemistry, 30 (10): 1545--1614 (2009)Lambda-dynamics free energy simulation methods, and . J Comput Chem, 30 (11): 1692-1700 (August 2009)Theoretical approaches to solvation of bio-polymers, and . Methods in Enzymology, (1986)Protein dynamics - application to active-sites of enzymes, , and . Abstracts of Papers of the American Chemical Society, 189 (APR-): 6--MEDI (1985)WExplore: hierarchical exploration of high-dimensional spaces using the weighted ensemble algorithm, and . Journal of Physical Chemistry B, 118 (13): 3532-3542 (April 2014)Structural and energetic effects of truncating long ranged interactions in ionic and polar fluids, , and . J. Chem. Phys., 83 (11): 5897--5908 (1985)