Reviews in Computational Chemistry, Volume 29

Omtale

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 TheoryLong-Range Inter-Particle Interactions: Insights from Molecular Quantum Electrodynamics (QED) TheoryEfficient Transition-State Modeling using Molecular Mechanics Force Fields for the Everyday ChemistMachine Learning in Materials Science: Recent Progress and Emerging ApplicationsDiscovering New Materials via a priori Crystal Structure PredictionIntroduction to Maximally Localized Wannier FunctionsMethods for a Rapid and Automated Description of Proteins: Protein Structure, Protein Similarity, and Protein Folding