Studying Interactions by Molecular Dynamics Simulations at High Concentration

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...

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Bibliographic Details
Main Authors: Federico Fogolari, Alessandra Corazza, Stefano Toppo, Silvio C. E. Tosatto, Paolo Viglino, Fulvio Ursini, Gennaro Esposito
Format: Article
Language:English
Published: Hindawi Limited 2012-01-01
Series:Journal of Biomedicine and Biotechnology
Online Access:http://dx.doi.org/10.1155/2012/303190