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Parallelization and Improvements of the Generalized Born Model with a Simple sWitching Function for Modern Graphics Processors
Two fundamental challenges of simulating biologically relevant systems are the rapid calculation of the energy of solvation, and the trajectory length of a given simulation. The Generalized Born model with a Simple sWitching function (GBSW) addresses these issues by using an efficient approximation...
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| 出版年: | J Comput Chem |
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| 主要な著者: | , |
| フォーマット: | Artigo |
| 言語: | Inglês |
| 出版事項: |
2016
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| 主題: | |
| オンライン･アクセス: | https://ncbi.nlm.nih.gov/pmc/articles/PMC4801733/ https://ncbi.nlm.nih.gov/pubmed/26786647 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1002/jcc.24280 |
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