Long range Debye-Hückel correction for computation of grid-based electrostatic forces between biomacromolecules

BACKGROUND: Brownian dynamics (BD) simulations can be used to study very large molecular systems, such as models of the intracellular environment, using atomic-detail structures. Such simulations require strategies to contain the computational costs, especially for the computation of interaction for...

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Detalles Bibliográficos
Autores principales: Mereghetti, Paolo, Martinez, Michael, Wade, Rebecca C
Formato: Online Artículo Texto
Lenguaje:English
Publicado: BioMed Central 2014
Materias:
Research Article
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4082500/
https://www.ncbi.nlm.nih.gov/pubmed/25045516
http://dx.doi.org/10.1186/2046-1682-7-4

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4082500/
https://www.ncbi.nlm.nih.gov/pubmed/25045516
http://dx.doi.org/10.1186/2046-1682-7-4

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