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An N log N approximation based on the natural organization of biomolecules for speeding up the computation of long range interactions
Presented here is a method, the hierarchical charge partitioning (HCP) approximation, for speeding up computation of pairwise electrostatic interactions in biomolecular systems. The approximation is based on multiple levels of natural partitioning of biomolecular structures into a hierarchical set o...
Tallennettuna:
| Päätekijät: | , |
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| Aineistotyyppi: | Artigo |
| Kieli: | Inglês |
| Julkaistu: |
2010
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| Aiheet: | |
| Linkit: | https://ncbi.nlm.nih.gov/pmc/articles/PMC2818067/ https://ncbi.nlm.nih.gov/pubmed/19569183 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1002/jcc.21357 |
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