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Computational approaches to protein dynamics : from quantum to coarse-grained methods

Title
Computational approaches to protein dynamics : from quantum to coarse-grained methods / editor, Monika Fuxreiter.
Format
E-Book
Published
Boca Raton : Taylor & Francis, [2015]
Description
1 online resource.
URL
Access for [All Campuses] - (Available on campus and off campus with authorized logon)
Other contributors
Fuxreiter, Monika, 1969- editor.
Uniform series
Series in computational physics.
Notes
Includes bibliographical references and index. Electronic reproduction. Ipswich, MA Available via World Wide Web.
Contents
  • Dynamics : a key to protein function / Mónika Fuxreiter
  • Adaptive and accurate force-based QM/MM calculations / Noam Bernstein, Iván Solt, Letif Mones, Csilla Várnai, Steven A. Winfield, and Gábor Csányi
  • Conformational and chemical landscapes of enzyme catalysis / Alexandra T. P. Carvalho, Fernanda Duarte, Konstantinos Vavitsas and Shina Caroline Lynn Kamerlin
  • Interplay between enzyme function and protein dynamics : a multiscale approach to the study of the NAG kinase family and two class II aldolases / Enrique Marcos, Melchor Sanchez-Martinez, and Ramon Crehuet
  • Simplified flexibility analysis of proteins / Yves-Henri Sanejouand
  • ABSINTH implicit solvation model and force field paradigm for use in simulations of intrinsically disordered proteins / Anuradha Mittal, Rahul K. Das, Andreas Vitalis, and Rohit V. Pappu
  • Intrinsically disordered protein : a thermodynamic perspective / Jing Li, James O. Wrabl, and Vincent J. Hilser
  • Long molecular dynamics simulations of intrinsically disordered proteins reveal preformed structural elements for target binding / Elio Cino, Mikko Karttunen, and Wing-Yiu Choy
  • Multiscale simulations of large conformational changes of disordered and ordered proteins induced by their partners / Yong Wang, Xiakun Chu, and Jin Wang
  • Coarse-grained simulation of intrinsically disordered proteins / David de Sancho, Christopher M. Baker, and Robert B. Best
  • Natural and directed evolution of intrinsically disordered proteins / Tali H. Reingewertz and Eric J. Sundberg
  • Discrete molecular dynamics : foundations and biomolecular applications / Pedro Sfriso, Agustí Emperador, Josep Lluis Gelpí, and Modesto Orozco
  • Use of ensemble methods to describe biomolecular dynamics by small angle x-ray scattering / Giancarlo Tria, Dmitri I. Svergun, and Pau Bernadó
  • Bridging experiments and simulations : structure calculations with a dynamical touch / Florian Heinkel, Alexander Cumberworth, and Jörg Gsponer.
Subject headings
Proteins--Conformation.
Medical subjects
Protein Conformation. Biophysical Phenomena. Computational Biology--methods. Intrinsically Disordered Proteins--chemistry. Molecular Dynamics Simulation. Proteins--chemistry.
ISBN
9781466561571 (hardcover : alk. paper) 1482297868 (electronic bk.) 9781482297867 (electronic bk.) 1466561572 (hardcover : alk. paper)

Holdings

Library
__Electronic resources available in all locations
Location
World Wide Web