Reviews in Computational Chemistry.

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THIS VOLUME, LIKE THOSE PRIOR TO IT, FEATURES CHAPTERS BY EXPERTS IN VARIOUS FIELDS OF COMPUTATIONAL CHEMISTRY. TOPICS COVERED IN VOLUME 20 INCLUDE VALENCE THEORY, ITS HISTORY, FUNDAMENTALS, AND APPLICATIONS; MODELING OF SPIN-FORBIDDEN REACTIONS; CALCULATION OF THE ELECTRONIC SPECTRA OF LARGE MOLECU...

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Bibliographic Details
Call Number:Libro Electrónico
Main Author: Lipkowitz, Kenny B.
Other Authors: Larter, Raima, Cundari, Tom R., Boyd, Donald B.
Format: Electronic eBook
Language:Inglés
Published: Hoboken : John Wiley & amp; Sons, Inc., 2004.
Series:Reviews in Computational Chemistry.
Subjects:
Chemistry > Data processing.
Chemistry > Computer simulation.
Cheminformatics.
Chimio-informatique.
Chimie > Simulation par ordinateur.
Cheminformatics
Chemistry > Computer simulation
Chemistry > Data processing
Online Access:Texto completo
Table of Contents:
  • Reviews in Computational Chemistry Volume 20; Preface; Contents; Contributors; Contributors to Previous Volumes; 1. Valence Bond Theory, Its History, Fundamentals, and Applications: A Primer; 2. Modeling of Spin-Forbidden Reactions; 3. Calculation of the Electronic Spectra of Large Molecules; 4. Simulating Chemical Waves and Patterns; 5. Fuzzy Soft-Computing Methods and Their Applications in Chemistry; 6. Development of Computational Models for Enzymes, Transporters, Channels, and Receptors Relevant to ADME/Tox; Author Index; Subject Index.

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