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Exploring a coarse-grained distributive strategy for finite-difference Poisson–Boltzmann calculations
We have implemented and evaluated a coarse-grained distributive method for finite-difference Poisson–Boltzmann (FDPB) calculations of large biomolecular systems. This method is based on the electrostatic focusing principle of decomposing a large fine-grid FDPB calculation into multiple independent F...
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| Hauptverfasser: | , |
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| Format: | Artigo |
| Sprache: | Inglês |
| Veröffentlicht: |
Springer-Verlag
2010
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| Schlagworte: | |
| Online Zugang: | https://ncbi.nlm.nih.gov/pmc/articles/PMC3143316/ https://ncbi.nlm.nih.gov/pubmed/21127924 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1007/s00894-010-0904-4 |
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