دانلود کتاب Crystallographic and Modeling Methods in Molecular Design

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Front Matter....Pages i-xvii
Inhibitor Binding to Thymidylate Synthase Is Mediated by Different Structural Determinants than Those That Promote Tight Binding to Dihydrofolate Reductase....Pages 1-8
Crystallographic and Pharmacological Studies of Antiviral Agents Against Human Rhinovirus....Pages 9-28
Structural Studies of Elastase-Inhibitor Complexes with ß-Lactams....Pages 29-42
Design of Purine Nucleoside Phosphorylase Inhibitors Using X-Ray Crystallography....Pages 43-55
The Potential Role of Solvation in the Dihydrofolate Reductase Species Selectivity of Trimethoprim....Pages 56-79
Crystallographic and Genetic Approaches Toward the Design of Proteins of Enhanced Thermostability....Pages 80-94
Stability of Folded Conformations by Computer Simulation: Methods and Some Applications....Pages 95-113
The Use of Molecular Dynamics and Free Energy Perturbation Approaches in Simulating the Properties of Macromolecules and Their Binding to Ligands....Pages 114-122
Molecular Recognition of DNA Minor Groove Binding Drugs....Pages 123-150
Structural and Computational Studies of Anticonvulsants: A Search for Correlation Between Molecular Systematics and Activity....Pages 151-160
Crystallography and Molecular Mechanics in Designing Drugs with Unknown Receptor Structure....Pages 161-174
Molecular Modeling with Substructure Libraries Derived from Known Protein Structures....Pages 175-188
O: A Macromolecule Modeling Environment....Pages 189-199
Inhibitor Design from Known Structures....Pages 200-210
The Cambridge Structural Database in Molecular Modeling: Systematic Conformational Analysis from Crystallographic Data....Pages 211-228
Preferred Interaction Patterns from Crystallographic Databases....Pages 229-253
Aladdin: A Real Tool for Stucture-Based Drug Design....Pages 254-263
Back Matter....Pages 265-269