Browsing NTNU Open by Author "Aurlien, Ragnhild"
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A Density Functional Theory Study of Hydrogen Transfer and Rotational Barriers in Vitamin E-like Molecules
Aurlien, Ragnhild (Master thesis, 2011)A study of the antioxidant property of two vitamin E simplifications with density functional theory has been done. In one of the simplifications the phytyl tail and the methyl group on the heterocyclic ring in vitamin E ...