Computational Structural Biology: Methods and Applications

Contents: Structure Prediction and Assessment Methods: Protein Fold Recognition and Threading (L J McGuffin); Assessment of Protein Structure Predictions (E Capriotti & M A Marti-Renom); From Structure to Function to Design: Evolution of Protein Folds (A N Lupas & K K Koretke); Atomistic Simulations of Reactions and Transition States (M Meuwly); Protein Protein Interactions and Aggregation Processes (R I Dima); Drug Discovery and Pharmacology: MD-Based Free Energy Simulations (M A Cuendet et al.); Structure-Based Computational Approaches to Drug Metabolism (M A Lill); New Frontiers in Experimental Methods: New Frontiers in X-ray Crystallography (C U Stirnimann & M G Grütter); New Frontiers in Characterizing Structure and Dynamics by NMR (M Nilges et al.); Selected Topics: Docking for Neglected Diseases as Community Efforts (M Podvinec et al.); Protein Structure Databases (M John et al.); Molecular Graphics in Structural Biology (A M Lesk et al.); and other chapters.