1st Edition
Virtual Screening in Drug Discovery
496 Pages
by
CRC Press
496 Pages
by
CRC Press
496 Pages
by
CRC Press
Also available as eBook on:
Virtual screening can reduce costs and increase hit rates for lead discovery by eliminating the need for robotics, reagent acquisition or production, and compound storage facilities. The increased robustness of computational algorithms and scoring functions, the availability of affordable computational power, and the potential for timely structural determination of target molecules, have provided... Read more
Perspectives on Virtual Screening. Compound and Hit Suitability for Virtual Screening. Ligand-Based Virtual Screening Approaches. Important Considerations Impacting Molecular Docking. Docking Strategies and Algorithms.
Biography
Juan Alvarez, Brian Shoichet
