On the properties of a single OPLS-UA model curcumin molecule in water, methanol and dimethyl sulfoxide. Molecular dynamics computer simulation results
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DOI: 10.5488/cmp.20.23003
Abstract: The properties of model solutions consisting of a solute --- single curcumin molecule in water, methanol and dimethyl sulfoxide solvents have been studied using molecular dynamics (MD) computer simulations in the isobaric-isothermal ensemble. The united… read more here.
Keywords: molecule; water; methanol dimethyl; curcumin molecule ... See more keywords