Reviews in Computational Chemistry, Volume 29

Released on by Abby L. Parrill
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  • Reviews in Computational Chemistry, Volume 29 Book Detail

  • Author : Abby L. Parrill
  • Release Date : 2016-03-09
  • Publisher : John Wiley & Sons
  • Genre : Science
  • Pages : 581
  • ISBN 13 : 1119157552
  • File Size : 53,53 MB
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Reviews in Computational Chemistry, Volume 29 by Abby L. Parrill PDF Summary

Book Description: The Reviews in Computational Chemistry series brings together leading authorities in the field to teach the newcomer and update the expert on topics centered on molecular modeling, such as computer-assisted molecular design (CAMD), quantum chemistry, molecular mechanics and dynamics, and quantitative structure-activity relationships (QSAR). This volume, like those prior to it, features chapters by experts in various fields of computational chemistry. Topics in Volume 29 include: Noncovalent Interactions in Density-Functional Theory Long-Range Inter-Particle Interactions: Insights from Molecular Quantum Electrodynamics (QED) Theory Efficient Transition-State Modeling using Molecular Mechanics Force Fields for the Everyday Chemist Machine Learning in Materials Science: Recent Progress and Emerging Applications Discovering New Materials via a priori Crystal Structure Prediction Introduction to Maximally Localized Wannier Functions Methods for a Rapid and Automated Description of Proteins: Protein Structure, Protein Similarity, and Protein Folding

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