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Theoretical approaches to solvation of bio-polymers, and . Methods in Enzymology, (1986)Harmonic-analysis of large systems .1. methodology, , and . J. Comp. Chem., 16 (12): 1522--1542 (1995)Protein dynamics - application to active-sites of enzymes, , and . Abstracts of Papers of the American Chemical Society, 189 (APR-): 6--MEDI (1985)Ph-dependence of protein stability: absolute electrostatic free energy differences between conformations, , and . J. Phys. Chem. B, 101 (9): 1663--1683 (1997)RESEARCH ARTICLES Effective Energy Function for Proteins in Solution, and . PROTEINS: Structure, Function, and Genetics, (1999)Understanding protein folding via free-energy surfaces from theory and experiment, , , , and . TRENDS IN BIOCHEMICAL SCIENCES, 25 (7): 331-339 (July 2000)Enhanced sampling in molecular dynamics: use of the time-dependent Hartree approximation for a simulation of carbon monoxide diffusion through myoglobin, and . Journal of the American Chemical Society, 112 (25): 9161-9175 (1990)Adaptive umbrella sampling of the potential energy: modified updating procedure of the umbrella potential and application to peptide folding, , and . Theor. Chem. Acc., 101 (1-3): 62--66 (1999)Molecular properties from combined qm/mm methods. i. analytical second derivative and vibrational calculations, and . J. Chem. Phys., 112 (3): 1133--1149 (2000)A theoretical analysis of the proton and hydride transfer in liver alcohol dehydrogenase (ladh), , and . J. Phys. Chem. B, 106 (10): 2721--2740 (2002)