书目名称 | Computer-Aided Drug Discovery | 编辑 | Wei Zhang | 视频video | | 概述 | Features practical, hands-on instruction for the use of CADD systems.Includes tips from experts in the field to ensure successful implementation.Focuses on the vital early stages of the drug discovery | 丛书名称 | Methods in Pharmacology and Toxicology | 图书封面 |  | 描述 | .This detailed volume examines computer-aided drug discovery (CADD), a crucial component of modern drug discovery programs that is widely utilized to identity and optimize bioactive compounds for the development of new drugs. With a focus on the methods that are commonly used in the early stage of drug discovery, chapters explore computer simulation, structure prediction, conformational sampling, binding site mapping, docking and scoring, in silico screening, and fragment-based drug design. In addition to the state-of-the-art theoretical concept, this book also includes step-by-step, readily reproducible computational protocols as well as examples of various CADD strategies. The limitations and potential pitfalls of different computational methods are discussed by experts, and tips and advice for their applications are suggested...Practical and thorough, .Computer-Aided Drug Discovery. serves as an ideal addition to the .Methods in Pharmacology and Toxicology. series, guiding researchers toward their lab’s goals with this exciting and versatile technology. | 出版日期 | Book 2016 | 关键词 | Computational technologies; Structure prediction; Fragment-based drug design; CADD; Binding site mapping | 版次 | 1 | doi | https://doi.org/10.1007/978-1-4939-3521-5 | isbn_softcover | 978-1-4939-8065-9 | isbn_ebook | 978-1-4939-3521-5Series ISSN 1557-2153 Series E-ISSN 1940-6053 | issn_series | 1557-2153 | copyright | Springer Science+Business Media New York 2016 |
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