Computational Approaches to Biochemical Reactivity - Understanding Chemical Reactivity Softcover reprint of the original 1st ed. 1997 edition

Marc Notes: Includes bibliographical references and index. Table of Contents: Preface; A. Warshel, G. Naray-Szabo. 1. Quantum Mechanical Models for Reactions in Solution; J. Tomasi, et al. 2. Free Energy Perturbation Calculations within Quantum Mechanical Methodologies; R. S. Standon, et al. 3. Hybrid Potentials for Molecular Systems in the Condensed Phase; M. J. Field. 4. Molecular Mechanics and Dynamics Simulations of Enzymes; R. H. Stote, et al. 5. Electrostatic Interactions in Proteins; K. A. Sharp. 6. Electrostatic Basis of Enzyme Catalysis; G. Naray-Szabo, et al. 7. On the Mechanisms of Proteinases; A. Goldblum. 8. Modelling of Proton Transfer Reactions in Enzymes; J. Aqvist. 9. Protein-Ligand Interactions; T. P. Lybrand. Subject Index."