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Understanding the Basics of QSAR for Applications in Pharmaceutical Sciences and Risk Assessment

Autor Kunal Roy, Supratik Kar, Rudra Narayan Das
en Limba Engleză Paperback – 2 mar 2015
Understanding the Basics of QSAR for Applications in Pharmaceutical Sciences and Risk Assessment describes the historical evolution of quantitative structure-activity relationship (QSAR) approaches and their fundamental principles. This book includes clear, introductory coverage of the statistical methods applied in QSAR and new QSAR techniques, such as HQSAR and G-QSAR. Containing real-world examples that illustrate important methodologies, this book identifies QSAR as a valuable tool for many different applications, including drug discovery, predictive toxicology and risk assessment. Written in a straightforward and engaging manner, this is the ideal resource for all those looking for general and practical knowledge of QSAR methods.

  • Includes numerous practical examples related to QSAR methods and applications
  • Follows the Organization for Economic Co-operation and Development principles for QSAR model development
  • Discusses related techniques such as structure-based design and the combination of structure- and ligand-based design tools
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Specificații

ISBN-13: 9780128015056
ISBN-10: 0128015055
Pagini: 484
Dimensiuni: 191 x 235 x 25 mm
Greutate: 0.84 kg
Editura: ELSEVIER SCIENCE

Public țintă

New researchers, professors and graduate students across the pharmaceutical sciences (including pharmacology, toxicology and medicinal chemistry); secondary audience of regulatory officials and risk assessors in toxicology and environmental health

Cuprins

Chapter 1: Background of QSAR and Historical developmentsChapter 2: Chemical information and DescriptorsChapter 3: Classical QSARChapter 4: Topological QSARChapter 5: Computational chemistryChapter 6: Selected Statistical methods in QSARChapter 7: Validation of QSAR modelsChapter 8: Introduction to 3D-QSARChapter 9: Newer QSAR techniquesChapter 10: Other related techniquesChapter 11: Future avenues

Recenzii

"... a handy reference for beginners in this field. Score: 62 - 2 Stars" --Doody's