By Gisbert Schneider

Systematically analyzing present tools and methods, this prepared reference covers quite a lot of molecular buildings, from organic-chemical medicines to peptides, Proteins and nucleic acids, in response to rising new drug periods derived from biomacromolecules.

a pacesetter within the box and one of many pioneers of this younger self-discipline has assembled right here the main sought after specialists from the world over to supply first-hand wisdom. whereas such a lot in their equipment and examples come from the realm of pharmaceutical discovery and improvement, the ways are both appropriate for chemical probes and diagnostics, insecticides, and the other molecule designed to engage with a organic process. a variety of photos and screenshots illustrate the numerous examples and procedure descriptions.

With its large and balanced assurance, it will 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 goal family-oriented compound libraries
* Molecular de novo layout by means of nature-inspired computing
* 3D QSAR techniques 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.

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