Virtual screening for bioactive molecules /
Recent progress in high-throughput screening, combinatorial chemistry and molecular biology has radically changed the approach to drug discovery in the pharmaceutical industry. New challenges in synthesis result in new analytical methods. At present, typically 100,000 to one million molecules have t...
| Other Authors: | , |
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| Format: | eBook |
| Language: | English |
| Published: |
Weinheim ; New York :
Wiley-VCH,
©2000.
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| Series: | Methods and principles in medicinal chemistry ;
v. 10. |
| Subjects: | |
| Online Access: | Connect to the full text of this electronic book |
Table of Contents:
- High-throughput screening and virtual screening: entry points to drug discovery / Richard M. Eglen, Gisbert Schneider, Hans-Joachim Böhm
- Library filtering systems and prediction of drug-like properties / W. Patrick Walters, Mark A. Murcko
- Prediction of physicochemical properties / Jeff J. Morris, Pierre P. Bruneau
- Descriptor-based similarity measures for screening chemical databases / John M. Barnard, Geoffrey M. Downs, Peter Willett
- Modelling structure-activity relationships / Gianpaolo Bravi [and others]
- Database profiling by neural networks / Jens Sadowski
- Pharmacophore pattern application in virtual screening, library design and QSAR / Andrew C. Good, Jonathan S. Mason, Stephen D. Pickett
- Evolutionary molecular design in virtual fitness landscapes / Gisbert Schneider
- Practical approaches to evolutionary design / Lutz Weber
- Understanding receptor-ligand interactions as a prerequisite for virtual screening / Gerhard Klebe [and others]
- Structure-based library design / Martin Stahl
- The measurement of molecular diversity / Dimitris K. Agrafiotis [and others].