Authors:
MARRONE TJ
RESAT H
HODGE CN
CHANG CH
MCCAMMON JA
Citation: Tj. Marrone et al., SOLVATION STUDIES OF DMP323 AND A76928 BOUND TO HIV PROTEASE - ANALYSIS OF WATER SITES USING GRAND-CANONICAL MONTE-CARLO SIMULATIONS, Protein science, 7(3), 1998, pp. 573-579
Citation: H. Resat et Ja. Mccammon, CORRECTING FOR ELECTROSTATIC CUTOFFS IN FREE-ENERGY SIMULATIONS - TOWARD CONSISTENCY BETWEEN SIMULATIONS WITH DIFFERENT CUTOFFS, The Journal of chemical physics, 108(23), 1998, pp. 9617-9623
Citation: M. Baginski et al., MOLECULAR-PROPERTIES OF AMPHOTERICIN-B MEMBRANE CHANNEL - A MOLECULAR-DYNAMICS SIMULATION, Molecular pharmacology, 52(4), 1997, pp. 560-570
Citation: H. Resat et al., THE SENSITIVITY OF CONFORMATIONAL FREE-ENERGIES OF THE ALANINE DIPEPTIDE TO ATOMIC SITE CHARGES, Biopolymers, 41(1), 1997, pp. 73-81
Citation: H. Resat et al., ENZYME-INHIBITOR ASSOCIATION THERMODYNAMICS - EXPLICIT AND CONTINUUM SOLVENT STUDIES, Biophysical journal, 72(2), 1997, pp. 522-532
Citation: H. Resat et al., USE OF THE GRAND-CANONICAL ENSEMBLE IN POTENTIAL OF MEAN FORCE CALCULATIONS, Journal of physical chemistry, 100(4), 1996, pp. 1426-1433
Citation: H. Resat et Ja. Mccammon, FREE-ENERGY SIMULATIONS - CORRECTING FOR ELECTROSTATIC CUTOFFS BY USEOF THE POISSON EQUATION, The Journal of chemical physics, 104(19), 1996, pp. 7645-7651
Citation: H. Resat et M. Mezei, GRAND-CANONICAL ENSEMBLE MONTE-CARLO SIMULATION OF THE DCPG PROFLAVINE CRYSTAL HYDRATE/, Biophysical journal, 71(3), 1996, pp. 1179-1190
Citation: Hl. Friedman et al., APPLICATIONS OF A MOLECULAR THEORY OF SOLVATION DYNAMICS, Journal of physics. Condensed matter, 6, 1994, pp. 10000131-10000136
Citation: H. Resat et M. Mezei, STUDIES ON FREE-ENERGY CALCULATIONS .2. A THEORETICAL APPROACH TO MOLECULAR SOLVATION, The Journal of chemical physics, 101(7), 1994, pp. 6126-6140
Citation: H. Resat et M. Mezei, GRAND-CANONICAL MONTE-CARLO SIMULATION OF WATER POSITIONS IN CRYSTAL HYDRATES, Journal of the American Chemical Society, 116(16), 1994, pp. 7451-7452
Citation: H. Resat et M. Mezei, STUDIES ON FREE-ENERGY CALCULATIONS .1. THERMODYNAMIC INTEGRATION USING A POLYNOMIAL PATH, The Journal of chemical physics, 99(8), 1993, pp. 6052-6061
Citation: H. Resat et al., STUDIES OF THE OPTICAL-LIKE HIGH-FREQUENCY DISPERSION MODE IN LIQUID WATER, The Journal of chemical physics, 98(9), 1993, pp. 7277-7280