|  | Oprea, Tudor I. (Hrsg.) Chemoinformatics in Drug Discovery Methods and Principles in Medicinal Chemistry (Band 23) Herausgegeben von Mannhold, Raimund / Kubinyi, Hugo / Folkers, Gerd
  1. Auflage - Januar 2005 205,- Euro 2005. XXII, 493 Seiten, Hardcover 149 Abb. (21 Farbabb.), 39 Tab. - Handbuch/Nachschlagewerk - ISBN-10: 3-527-30753-2 ISBN-13: 978-3-527-30753-1 - Wiley-VCH, Weinheim
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Probekapitel
Langtext This handbook provides the first-ever inside view of today's integrated approach to rational drug design. Chemoinformatics experts from large pharmaceutical companies, as well as from chemoinformatics service providers and from academia demonstrate what can be achieved today by harnessing the power of computational methods for the drug discovery process. With the user rather than the developer of chemoinformatics software in mind, this book describes the successful application of computational tools to real-life problems and presents solution strategies to commonly encountered problems. It shows how almost every step of the drug discovery pipeline can be optimized and accelerated by using chemoinformatics tools -- from the management of compound databases to targeted combinatorial synthesis, virtual screening and efficient hit-to-lead transition. An invaluable resource for drug developers and medicinal chemists in academia and industry.
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