Computational Chemistry Methods in Structural Biology

Erscheinungsjahr 2011
ISBN: 978-0-12-386485-7
Verlag: William Andrew Publishing

Buch, Englisch, 360 Seiten, Format (B × H): 152 mm x 229 mm, Gewicht: 710 g

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.

Zielgruppe

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

Autoren/Hrsg.

Weitere Mitwirkende

Christov, Christo

Fachgebiete

• Naturwissenschaften Chemie Organische Chemie Biochemie
• Naturwissenschaften Chemie Chemie Allgemein Chemometrik, Chemoinformatik

Inhaltsverzeichnis

- New computational strategies for designing enzyme inhibitorsJuan Andres

- Theoretical Investigation of enzyme-inhibitor interactionsAlessio Lodola

- Recent advances in molecular modelling of endocrine disruptorsIvanka Tsakovska

- Multiscale Simulation Methods for Mapping Conformational Ensembles of G-Protein Coupled ReceptorsNagarajan Vaidehi

- Advances in implicit models of water solvent for method vof molecular dynamics and applications to study macromolecular complexes, ligand docking and pH-dependent effectsYury Vorobjev

- Free Energy Methods for the Prediction and Analysis of Protein-Ligand Binding AffinitiesEmilio Gallicchio

- Coarse-Grained Modelling of Protein FlexibilityModesto Orozco

Über Autor(innen)

Christov, Christo
Dr. Christo Z. Christov teaches at Northumbria University, Ellison Building, Newcastle-upon-Tyne, UK