Reviews in Computational Chemistry, Volume 28

Reviews in Computational Chemistry, Volume 28

Autor: Abby L. Parrill, Kenny B. Lipkowitz
Wydawca: Wiley
Wydanie: 1
Data publikacji: 2015
ISBN: 9781118407776

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The Reviews in Computational Chemistry series brings together leading authorities in the field to teach the newcomer and update the expert on topics centered around 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 28 include:

  • Free-energy Calculations with Metadynamics
  • Polarizable Force Fields for Biomolecular Modeling
  • Modeling Protein Folding Pathways
  • Assessing Structural Predictions of Protein-Protein Recognition
  • Kinetic Monte Carlo Simulation of Electrochemical Systems
  • Reactivity and Dynamics at Liquid Interfaces

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