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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...

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Detalles Bibliográficos
Clasificación:Libro Electrónico
Otros Autores: Christov, Christo I.
Formato: Electrónico eBook
Idioma:Inglés
Publicado: Amsterdam : Elsevier Academic Press, 2011.
Colección:Advances in protein chemistry and structural biology ; v. 85.
Temas:
Acceso en línea:Texto completo
Tabla de Contenidos:
  • Application of computational methods to the design of fatty acid amide hydrolase (FAAH) inhibitors based on a carbamic template structure
  • Recent theoretical and computational advances for modeling protein-ligand binding affinities
  • Hybrid schemes based on quantum mechanics/molecular mechanics simulations: goals to success, problems, and perspectives
  • Exploring membrane and protein dynamics with dissipative particle dynamics
  • Coarse-grained representation of protein flexibility: foundations, successes, and shortcomings
  • Recent advances in the molecular modeling of estrogen receptor-mediated toxicity
  • Multiscale computational methods for mapping conformational ensembles of G-protein-coupled receptors
  • Advances in implicit models of water solvent to compute conformational free energy and molecular dynamics of proteins at constant pH.