Computational chemistry methods in structural biology book cover

Computational chemistry methods in structural biology

Published continuously since 1944, the Advances in Protein Chemistry and Structural Biology serial has been a continuous, essential resource for protein chemists. Covering reviews of methodology and research in all aspects of protein chemistry, including purification/expression, proteomics, modeling and structural determination and design, each volume brings forth new information about protocols and analysis of proteins while presenting the most recent findings from leading experts in a broad range of protein-related topics. This volume features articles on Computational Chemistry methods in Structural Biology.

Audience
Biochemists, biophysicists, cell biologists, protein chemists, structural geneticists, and structural biologists

Hardbound, 360 Pages

Published: September 2011

Imprint: Academic Press

ISBN: 978-0-12-386485-7

Contents

    1. New computational strategies for designing enzyme inhibitors
      Juan Andres
    2. Theoretical Investigation of enzyme-inhibitor interactions
      Alessio Lodola
    3. Recent advances in molecular modelling of endocrine disruptors
      Ivanka Tsakovska
    4. Multiscale Simulation Methods for Mapping Conformational Ensembles of G-Protein Coupled Receptors
      Nagarajan Vaidehi
    5. Advances in implicit models of water solvent for method vof molecular dynamics and applications to study macromolecular complexes, ligand docking and pH-dependent effects
      Yury Vorobjev
    6. Free Energy Methods for the Prediction and Analysis of Protein-Ligand Binding Affinities
      Emilio Gallicchio
    7. Coarse-Grained Modelling of Protein Flexibility
      Modesto Orozco

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