Drude Polarizable Lipid Force Field with Explicit Treatment of Long-Range Dispersion: Parametrization and Validation for Saturated and Monounsaturated Zwitterionic Lipids
| Autor: | Yalun Yu, Richard M. Venable, Jonathan Thirman, Payal Chatterjee, Anmol Kumar, Richard W. Pastor, Benoît Roux, Alexander D. MacKerell, Jeffery B. Klauda |
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| Rok vydání: | 2023 |
| Předmět: | |
| Zdroj: | Journal of Chemical Theory and Computation. 19:2590-2605 |
| ISSN: | 1549-9626 1549-9618 |
| Databáze: | OpenAIRE |
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