CHEMOGENOMICS
Knowledge-based Approaches to Drug Discovery
CONTENTS
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FRONT MATTER
| i |
Small Molecules for Chemogenomicsbased Drug Discovery
Edgar Jacoby, Ansgar Schuffenhauer, Kamal Azzaoui, Maxim Popov, Sigmar Dressler, Meir Glick, Jeremy Jenkins, John Davies and Silvio Roggo | 1 |
Mapping the Chemogenomic Space
Jordi Mestres | 39 |
Natural Product Scaffolds and Protein Structure Similarity Clustering (PSSC) as Inspiration Sources for Compound Library Design in Chemogenomics and Drug Development
Frank J. Dekker, Stefan Wetzel and Herbert Waldmann | 59 |
A Reductionist Approach to Chemogenomics in the Design of Drug Molecules and Focused Libraries
Roger Crossley and Martin Slater | 85 |
In silico Screening of the Protein Structure Repertoire and of Protein Families
Didier Rognan | 109 |
New Methods for Similarity-based Virtual Screening
Jérôme Hert, Peter Willett and David J. Wilton | 133 |
Structural Informatics: Chemogenomics In silico
Derek A. Debe, Kevin P. Hambly and Joseph F. Danzer | 157 |
Construction of a Homogeneous and Informative In vitro Profiling Database for Anticipating the Clinical Effects of Drugs
Nicolas Froloff, Valérie Hamon, Philippe Dupuis, Annie Otto-Bruc, Boryeu Mao, Sandra Merrick and Jacques Migeon | 175 |
BACK MATTER
| 207 |
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