Studying Interactions by Molecular Dynamics Simulations at High Concentration
Joint Authors
Viglino, Paolo
Fogolari, Federico
Esposito, Gennaro
Ursini, Fulvio
Tosatto, Silvio C. E.
Corazza, Alessandra
Toppo, Stefano
Source
Journal of Biomedicine and Biotechnology
Issue
Vol. 2012, Issue 2012 (31 Dec. 2012), pp.1-9, 9 p.
Publisher
Hindawi Publishing Corporation
Publication Date
2012-02-22
Country of Publication
Egypt
No. of Pages
9
Main Subjects
Abstract EN
Molecular dynamics simulations have been used to study molecular encounters and recognition.
In recent works, simulations using high concentration of interacting molecules have been performed.
In this paper, we consider the practical problems for setting up the simulation and to analyse the results of the simulation.
The simulation of beta 2-microglobulin association and the simulation of the binding of hydrogen peroxide by glutathione peroxidase are provided as examples.
American Psychological Association (APA)
Fogolari, Federico& Corazza, Alessandra& Toppo, Stefano& Tosatto, Silvio C. E.& Viglino, Paolo& Ursini, Fulvio…[et al.]. 2012. Studying Interactions by Molecular Dynamics Simulations at High Concentration. Journal of Biomedicine and Biotechnology،Vol. 2012, no. 2012, pp.1-9.
https://search.emarefa.net/detail/BIM-461770
Modern Language Association (MLA)
Fogolari, Federico…[et al.]. Studying Interactions by Molecular Dynamics Simulations at High Concentration. Journal of Biomedicine and Biotechnology No. 2012 (2012), pp.1-9.
https://search.emarefa.net/detail/BIM-461770
American Medical Association (AMA)
Fogolari, Federico& Corazza, Alessandra& Toppo, Stefano& Tosatto, Silvio C. E.& Viglino, Paolo& Ursini, Fulvio…[et al.]. Studying Interactions by Molecular Dynamics Simulations at High Concentration. Journal of Biomedicine and Biotechnology. 2012. Vol. 2012, no. 2012, pp.1-9.
https://search.emarefa.net/detail/BIM-461770
Data Type
Journal Articles
Language
English
Notes
Includes bibliographical references
Record ID
BIM-461770