Molecular Modelling and Drug Design
Jeremy G. Vinter, Mark Gardner · Medical Entomology and Zoology · 1994
Preface. Molecular Modelling Methods, W. Wylie. Molecular Mechanics: Problems and Potential, J. Goodman. The Global Minimum Problem in Molecular Mechanics: Simulated Annealing and Related Techniques, S.D. Morley. The Castlemaine Project: Development of an AI-Based Drug Design Support System, E. Hodgkin. A Discussion of Various Computational Methods for Drug Design, R. Lewis and E. Meng. Applications of Artificial Intelligence in Molecular Modelling and Drug Design, A. Leach. The Calculation, Representation, and Analysis of Molecular Fields, P.W. Finn. Molecular Similarity Calculations for the Rational Design of Bioactive Materials, C. Burt. Multivariate OSAR and Computational Chemistry: A Novel Receptor Model of the D1 Agonist Binding Site, D. Manallack. A Perspective of Peptide Modelling, H. Broughton. The Developer's Perspective-What Can be Achieved in Hardware and Software, M. Sauders. Index.