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Computational molecular biology /

This book covers applications of computational techniques to biological problems. These techniques are based by an ever-growing number of researchers with different scientific backgrounds - biologists, chemists, and physicists. The rapid development of molecular biology in recent years has been mirr...

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Detalles Bibliográficos
Clasificación:Libro Electrónico
Otros Autores: Leszczynski, Jerzy, 1949-
Formato: Electrónico eBook
Idioma:Inglés
Publicado: Amsterdam ; New York : Elsevier, 1999.
Edición:1st ed.
Colección:Theoretical and computational chemistry ; 8.
Temas:
Acceso en línea:Texto completo
Texto completo
Texto completo
Tabla de Contenidos:
  • Chapter 1. Hybrid potentials for large molecular systems.
  • 2. Proton transfer in models biomolecules.
  • 3. Computational approaches to the studies of the interactions of nucleic acid bases.
  • 4. Nucleic acid bases in solution.
  • 5. Current trends in modeling interactions of DNA fragments with polar solvents.
  • 6. Radiation-induced DNA damage and repair: An approach from ab initio MO method.
  • 7. Application of molecular orbital theory to elucidation of radical processes induced by radiation damage to DNA.
  • 8. Exploring the structural repertoire of Guanine-rich DNA sequences: Computer modeling studies.
  • 9. The calculation of relative binding thermodynamics of molecular associations in aqueous environments.
  • 10. Theoretical tools for analysis and modeling electrostatic effects in biomolecules.
  • 11. Application of reduced models to protein structure prediction.
  • 12. Modeling DNA-protein interactions.
  • 13. Interactions of small molecules and peptides with membranes.
  • 14. Modeling of antifreeze proteins.
  • 15. The role of computational techniques in retrometabolic drug design strategies.
  • 16. Computational aspects of neural membrane biophysics.
  • Index.
  • Hybrid potentials for large molecular systems / P. Amara and M.J. Field
  • Proton transfer in models biomolecules / S. Scheiner
  • Computational approaches to the studies of the interactions of nucleic acid bases / J. �Sponer, P. Hobza and J. Leszczynski
  • Nucleic acid bases in solution / M. Orozco [and others]
  • Current trends in modeling interactions of DNA fragments with polar solvents / L. Gorb and J. Leszczynski
  • Radiation-induced DNA damage and repair : an approach from ab initio MO method / M. Aida, M. Kaneko and M. Dupuis
  • Application of molecular orbital theory to elucidation of radical processes induced by radiation damage to DNA / A.-O. Colson and M.D. Sevilla
  • Exploring the structural repertoire of Guanine-rich DNA sequences : computer modelling studies / M. Bansal, M. Ravikiran and S. Chowdhury
  • The calculation of relative binding thermodynamics of molecular associations in aqueous environments / G.J. Tawa, I.A. Topol and S.K. Burt
  • Theoretical tools for analysis and modelling electrostatic effects in biomolecules / W.A. Sokalski [and others]
  • Application of reduced models to protein structure prediction / J. Skolnick, A. Kolinski and A.R. Ortiz
  • Modelling DNA-protein interactions / K. Zakrzewska and R. Lavery
  • Interactions of small molecules and peptides with membranes / A. Pohorille [and others]
  • Modeling of antifreeze proteins / J.D. Madura and A. Wierzbicki
  • The role of computational techniques in retrometabolic drug design strategies / N. Bodor, P. Buchwald and M.-J. Huang
  • Computational aspects of neural membrane biophysics / R. Wallace.