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A Transferable Coarse-Grained Model for Hydrogen Bonding Liquids
We present here a recent development of a generalized coarse-grained model for use in molecular simulations. In this model, interactions between coarse-grained particles consist of both van der Waals and explicit electrostatic components. As a result, the coarse-grained model offers the transferabil...
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| Main Authors: | , , |
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| Formato: | Artigo |
| Idioma: | Inglês |
| Publicado em: |
2008
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| Assuntos: | |
| Acesso em linha: | https://ncbi.nlm.nih.gov/pmc/articles/PMC2443098/ https://ncbi.nlm.nih.gov/pubmed/18688358 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1039/b715841f |
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