TY  - BOOK
AU  - Doucet,Jean-Pierre
AU  - Panaye,Annick
TI  - Three dimensional QSAR: applications in pharmacology and toxicology 
T2  - QSAR in environmental and health sciences
SN  - 9781420091168 (ebook : PDF)
PY  - 2010///
CY  - Boca Raton
PB  - CRC Press
KW  - QSAR (Biochemistry)
KW  - Pharmacology
KW  - Research
KW  - Methodology
KW  - Toxicology
KW  - Electronic books
KW  - lcsh
N1  - Includes bibliographical references (p. 467-520) and index; pt. 1. Actual 3D models -- pt. 2. Around the 3D approaches -- pt. 3. Beyond 3D -- pt. 4. Receptor-related models; Also available in print edition
N2  - "Experiencing rapid growth over the last 15 years, quantitative structure-activity relationships (QSAR) continue to evolve quickly with an explosion of new tools and techniques. These techniques now play an increasing role in drug design and chemical risk assessment. New molecular descriptors based on three-dimensional structures incorporate a range of classical approaches, including regression and PLS analysis, as well as new nonlinear approaches, such as neural networks and support vector machines. Three-Dimensional QSAR addresses the scope and limitations of different modeling techniques using case studies from pharmacology, toxicology, and ecotoxicology to demonstrate the utility of each technique"--Provided by publisher
UR  - http://marc.crcnetbase.com/isbn/9781420091168
ER  -