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- W2065611537 abstract "Abstract Molecular dynamics simulations of aqueous solutions of l -ascorbic acid and l -dehydroascorbic acid were performed to evaluate their influence on the dynamical properties and structure of water. The simulations show that the presence of vitamin C very strongly disturbs the hydrogen bonding pattern of the SPC/E water as well as its dynamics properties, producing a simultaneous decrease in water bonded molecules and a diminution of the diffusion coefficient, the oxidized form being responsible for the more remarkable changes. These results are in agreement with those observed by low-frequency Raman scattering, which states that the AA influences the deformations on the temporal tetrahedral water structure." @default.
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- W2065611537 date "1999-10-01" @default.
- W2065611537 modified "2023-10-18" @default.
- W2065611537 title "Dynamical properties of water in aqueous solutions of l -ascorbic and dehydroascorbic acids; molecular dynamics simulations" @default.
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- W2065611537 doi "https://doi.org/10.1016/s0166-1280(99)00026-3" @default.
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