Drug design strategies : computational techniques and applications

• Other Authors: Banting, Lee., Clark, Tim, 1949-
• Format: eBook
• Language: English
• Published: Cambridge, U.K. : Royal Society of Chemistry, 2012.
• Series: RSC drug discovery series ; 20.
• Subjects: Drugs > Design > Computer simulation.; Drugs > Design.; Computer simulation.; Digital computer simulation.; Chemical models.; QSAR (Biochemistry); elektronické knihy; electronic books
• ISBN: 9781849733403; 1849733406; 9781621981398; 1621981398; 9781849731676; 1849731675
• Physical Description: 1 online resource (x, 239 pages) : illustrations

This book documents the latest research into the theory and application of force-fields, semi-empirical molecular orbital, density functional and ab initio calculations, Quantum Mechanical (QM) based modelling, Atoms in Molecules (AIM) approach, and biomolecular dynamics. It also covers theory and a...