New PDF release: De novo Molecular Design
By Gisbert Schneider
ISBN-10: 3527334610
ISBN-13: 9783527334612
a pace-setter within the box and one of many pioneers of this younger self-discipline has assembled right here the main fashionable specialists from internationally to supply first-hand wisdom. whereas so much in their equipment and examples come from the world of pharmaceutical discovery and improvement, the methods are both acceptable for chemical probes and diagnostics, insecticides, and the other molecule designed to have interaction with a organic method. a number of pictures and screenshots illustrate the numerous examples and approach descriptions.
With its huge and balanced assurance, this can be the firststop source not just for medicinal chemists, biochemists and biotechnologists, yet both for bioinformaticians and molecular designers for a few years to come.
From the content:
* Reaction-driven de novo design
* Adaptive tools in molecular design
* layout of ligands opposed to multitarget profiles
* loose power equipment in ligand design
* Fragment-based de novo design
* automatic layout of concentrated and objective family-oriented compound libraries
* Molecular de novo layout by way of nature-inspired computing
* 3D QSAR ways to de novo drug design
* Bioisosteres in de novo design
* De novo layout of peptides, proteins and nucleic acid constructions, together with RNA aptamers
and plenty of more.
Read or Download De novo Molecular Design PDF
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De novo Molecular Design by Gisbert Schneider
by Anthony
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