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An Empirical Polarizable Force Field Based on the Classical Drude Oscillator Model: Development History and Recent Applications
[Image: see text] Molecular mechanics force fields that explicitly account for induced polarization represent the next generation of physical models for molecular dynamics simulations. Several methods exist for modeling induced polarization, and here we review the classical Drude oscillator model, i...
Enregistré dans:
| Publié dans: | Chem Rev |
|---|---|
| Auteurs principaux: | , , , |
| Format: | Artigo |
| Langue: | Inglês |
| Publié: |
American
Chemical Society
2016
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| Accès en ligne: | https://ncbi.nlm.nih.gov/pmc/articles/PMC4865892/ https://ncbi.nlm.nih.gov/pubmed/26815602 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/acs.chemrev.5b00505 |
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