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An integrated computational approach to the analysis of NMR relaxation in proteins: application to ps-ns mainchain (15)N-(1)H and global dynamics of the Rho GTPase binding domain of plexin-B1

An integrated computational methodology for interpreting NMR spin relaxation in proteins has been developed. It combines a two-body coupled-rotator stochastic model with a hydrodynamics-based approach for protein diffusion, together with molecular dynamics based calculations for the evaluation of th...

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Autors principals: Zerbetto, Mirco, Buck, Matthias, Meirovitch, Eva, Polimeno, Antonino
Format: Artigo
Idioma:Inglês
Publicat: 2010
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Accés en línia:https://ncbi.nlm.nih.gov/pmc/articles/PMC3079214/
https://ncbi.nlm.nih.gov/pubmed/21142011
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/jp108633v
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