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“New-version-fast-multipole-method” accelerated electrostatic interactions in biomolecular systems
In this paper, we present an efficient and accurate numerical algorithm for calculating the electrostatic interactions in biomolecular systems. In our scheme, a boundary integral equation (BIE) approach is applied to discretize the linearized Poisson-Boltzmann (PB) equation. The resulting integral f...
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| Auteurs principaux: | , , |
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| Format: | Artigo |
| Langue: | Inglês |
| Publié: |
2007
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| Sujets: | |
| Accès en ligne: | https://ncbi.nlm.nih.gov/pmc/articles/PMC2084081/ https://ncbi.nlm.nih.gov/pubmed/18379638 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1016/j.jcp.2007.05.026 |
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