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Hydration Thermodynamics of Non-Polar Aromatic Hydrocarbons: Comparison of Implicit and Explicit Solvation Models

The precise description of solute-water interactions is essential to understand the chemo-physical nature in hydration processes. Such a hydration thermodynamics for various solutes has been explored by means of explicit or implicit solvation methods. Using the Poisson-Boltzmann solvation model, the...

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Detalles Bibliográficos
Autores principales:	Lee, Hankyul, Lim, Hyung-Kyu, Kim, Hyungjun
Formato:	Online Artículo Texto
Lenguaje:	English
Publicado:	MDPI 2018
Materias:	Article
Acceso en línea:	https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6278349/ https://www.ncbi.nlm.nih.gov/pubmed/30423973 http://dx.doi.org/10.3390/molecules23112927

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