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Reviews in Computational Chemistry, Volume 2

Editat de Kenny B Lipkowitz, Donald B Boyd
en Limba Engleză Hardback – 17 dec 1996
This second volume of the series 'Reviews in Computational Chemistry' explores new applications, new methodologies, and new perspectives. The topics covered include conformational analysis, protein folding, force field parameterizations, hydrogen bonding, charge distributions, electrostatic potentials, electronic spectroscopy, molecular property correlations, and the computational chemistry literature. Methodologies described include conformational search strategies, distance geometry, molecular mechanics, molecular dynamics, ab initio and semiempirical molecular orbital calculations, and quantitative structure-activity relationships (QSAR) using topological and electronic descriptors. A compendium of molecular modeling software will help users select the computational tools they need. Each chapter in 'Reviews in Computational Chemistry' serves as a brief tutorial for organic, physical, pharmaceutical, and biological chemists new to the field. Practitioners will be interested in the recent advances.
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Specificații

ISBN-13: 9780471188100
ISBN-10: 0471188107
Pagini: 544
Dimensiuni: 161 x 240 x 34 mm
Greutate: 0.98 kg
Ediția:Volume 2 edition
Editura: Wiley
Locul publicării:Hoboken, United States

Public țintă

Chemists,
Computer Scientists,
Chemical Industry,
Chemical Institutes

Notă biografică

Kenny B. Lipkowitz, PhD, is a retired Professor of Chemistry from North Dakota State University.
Donald B. Boyd was apponted Research Professor of Chemistry at Indiana University - Purdue University Indianapolis in 1994. He has published over 100 refereed journal papers and book chapters.

Descriere

This second volume of the series 'Reviews in Computational Chemistry' explores new applications, new methodologies, and new perspectives.