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Water-Exclusion and Liquid-Structure Forces in Implicit Solvation
A continuum model of solvation is proposed to describe: i) long-range electrostatic effects of water exclusion resulting from incomplete and anisotropic hydration in crowded environments, and ii) short-range effects of liquid-structure forces on the hydrogen-bond interactions at solute/water interfa...
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| Main Authors: | , |
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| Formato: | Artigo |
| Idioma: | Inglês |
| Publicado em: |
2011
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| Assuntos: | |
| Acesso em linha: | https://ncbi.nlm.nih.gov/pmc/articles/PMC3415305/ https://ncbi.nlm.nih.gov/pubmed/22007697 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/jp208184e |
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