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RPYFMM: Parallel Adaptive Fast Multipole Method for Rotne-Prager-Yamakawa Tensor in Biomolecular Hydrodynamics Simulations

RPYFMM is a software package for the efficient evaluation of the potential field governed by the Rotne-Prager-Yamakawa (RPY) tensor interactions in biomolecular hydrodynamics simulations. In our algorithm, the RPY tensor is decomposed as a linear combination of four Laplace interactions, each of whi...

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Detalhes bibliográficos
Publicado no:Comput Phys Commun
Main Authors: Guan, W., Cheng, X., Huang, J., Huber, G., Li, W., McCammon, J. A., Zhang, B.
Formato: Artigo
Idioma:Inglês
Publicado em: 2018
Assuntos:
Acesso em linha:https://ncbi.nlm.nih.gov/pmc/articles/PMC6107314/
https://ncbi.nlm.nih.gov/pubmed/30147116
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1016/j.cpc.2018.02.005
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