By Sun Hongmao
This booklet will not be an exhaustive survey protecting all elements of rational drug layout. in its place, it's going to offer serious information via real-world examples. proper case experiences can be awarded and analyzed to demonstrate the subsequent: how one can optimize a lead compound even if one has excessive or low degrees of structural details; find out how to derive hits from opponents’ lively compounds or from normal ligands of the pursuits; find out how to springboard from opponents’ SAR wisdom in lead optimization; the best way to layout a ligand to intrude with protein-protein interactions via appropriately reading the PPI interface; the right way to dodge IP blockage utilizing information mining; the best way to build and completely make the most of a knowledge-based molecular descriptor process; find out how to construct a competent QSAR version by way of targeting information caliber and correct number of molecular descriptors and statistical ways. A functional advisor to Rational Drug Design specializes in computational drug layout, with simply simple insurance of biology and chemistry concerns, akin to assay layout, goal validation and artificial routes.
- Discusses various tactics appropriate to day-by-day drug layout
- Readers can obtain the fabrics utilized in the ebook, together with constructions, scripts, uncooked information, protocols, and codes, making this e-book appropriate source for brief classes or workshops
- Offers a different perspective on drug discovery learn a result of author’s cross-discipline schooling background
- Explores the author’s wealthy reviews in either pharmaceutical and educational settings
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A Practical Guide to Rational Drug Design by Sun Hongmao