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Roles of Boundary Conditions in DNA Simulations: Analysis of Ion Distributions with the Finite-Difference Poisson-Boltzmann Method

The wide use of lattice-sum strategies in biomolecular simulations has raised many questions on potential artifacts in these strategies. One interesting question is the artifacts in the counterion distributions of highly charged systems. As one would anticipate, Coulombic interactions under the peri...

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Autors principals: Ye, Xiang, Cai, Qin, Yang, Wei, Luo, Ray
Format: Artigo
Idioma:Inglês
Publicat: The Biophysical Society 2009
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Accés en línia:https://ncbi.nlm.nih.gov/pmc/articles/PMC2711334/
https://ncbi.nlm.nih.gov/pubmed/19619470
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1016/j.bpj.2009.05.012
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