Reviews in computational chemistry . Volume 18 [[electronic resource] /] / edited by Kenny B. Lipkowitz and Donald B. Boyd

• Pubblicazione: New York, N.Y., : Wile-VCH, c2002
• Edizione: 1st ed.
• Descrizione fisica: 1 online resource (384 p.)
• Disciplina: 542.85; 542/.8
• Soggetto topico: Chemistry - Data processing; Chemistry - Mathematics
• Altri autori: BoydDonald B LipkowitzKenny B
• Note generali: Description based upon print version of record.
• Nota di bibliografia: Includes bibliographical references and index.
• Nota di contenuto: Reviews in Computational Chemistry Volume 18; Preface; Epilogue and Dedication; Contents; Contributors; Contributors to Previous Volumes*; Topics Covered in Volumes 1-18*; 1. Clustering Methods and Their Uses in Computational Chemistry; 2. The Use of Scoring Functions in Drug Discovery Applications; 3. Potentials and Algorithms for Incorporating Polarizability in Computer Simulations; 4. New Developments in the Theoretical Description of Charge-Transfer Reactions in Condensed Phases; 5. Linear Free Energy Relationships Using Quantum Mechanical Descriptors ; 6. The Development of Computational Chemistry in GermanyAppendix. Examination of the Employment Environment for Computational Chemistry; Author Index; Subject Index
• Sommario/riassunto: This volume, like those prior to it, features chapters by experts in various fields of computational chemistry. Topics covered in Volume 18 include molecular modeling, computer-assisted molecular design (camd), quantum chemistry, molecular mechanics and dynamics, and quantitative structure-activity relationships (qsar).
• Titolo autorizzato: Reviews in computational chemistry
• ISBN: 1-280-36682-6; 9786610366828; 0-470-34940-9; 0-471-46142-3; 0-471-43351-9
• Formato: Materiale a stampa
• Livello bibliografico: Monografia
• Lingua di pubblicazione: Inglese
• Record Nr.: 996201053203316
• Lo trovi qui: Univ. di Salerno
• Serie: Reviews in Computational Chemistry