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The Interaction of Sorbitol with Caffeine in Aqueous Solution

Molecular dynamics simulations were carried out on a system of caffeine interacting with the sugar alcohol sorbitol. The system examined had a caffeine concentration 0.083 m and a sugar concentration 1.08 m. The trajectories of all molecules in the system were collected over a period of 80 ns and an...

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Autors principals: Tavagnacco, Letizia, Brady, John W., Cesàro, Attilio
Format: Artigo
Idioma:Inglês
Publicat: 2013
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Accés en línia:https://ncbi.nlm.nih.gov/pmc/articles/PMC3758476/
https://ncbi.nlm.nih.gov/pubmed/24000279
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1007/s11483-013-9290-7
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