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On the Application of Accelerated Molecular Dynamics to Liquid Water Simulations
Our group recently proposed a robust bias potential function that can be used in an efficient all-atom accelerated molecular dynamics approach to simulate the transition of high energy barriers without any advance knowledge of the potential energy landscape. The main idea is to modify the potential-...
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| 主要な著者: | , , |
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| フォーマット: | Artigo |
| 言語: | Inglês |
| 出版事項: |
2006
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| 主題: | |
| オンライン･アクセス: | https://ncbi.nlm.nih.gov/pmc/articles/PMC2556231/ https://ncbi.nlm.nih.gov/pubmed/17092018 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/jp062845o |
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