Annual Reports in Computational Chemistry book cover

Annual Reports in Computational Chemistry

Annual Reports in Computational Chemistry provides timely and critical reviews of important topics in computational chemistry as applied to all chemical disciplines. Topics covered include quantum chemistry, molecular mechanics, force fields, chemical education, and applications in academic and industrial settings. Focusing on the most recent literature and advances in the field, each article covers a specific topic of importance to computational chemists.


Researchers and students interested in computational chemistry

Paperback, 128 Pages

Published: October 2013

Imprint: Elsevier

ISBN: 978-0-444-62672-1


  • Section A: Quantum Chemistry (Section Editor: Gregory S. Tschumper)
    1. Ligand Steric Descriptors
      Jenna A. Bilbrey and Wesley D. Allen

    2. Efficient Monomer-Based Quantum Chemistry Methods for Molecular and Ionic Clusters
      Leif D. Jacobson, Ryan M. Richard, Ka Un Lao and John M. Herbert

      Section B: Bioinformatics (Section Editor: Wei Wang)

    3. Atomistic Modeling of Phospho-Peptide Recognition for Modular Domains
      Chia-en A. Chang and Yu-ming M. Huang


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