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Browsing by Subject "electronic descriptors"

Browsing by Subject "electronic descriptors"

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  • Alnajjar, Radwan; Kawafi, Nagwa; Elmhdw, Maraia; Kamunya, Stephanie; Eltumi, Salem; F. Mohamed, Najwa (Department of Pharmaceutical chemistry, Benghazi University, Libya, 2020-12-02)
    In this work, Atorvastatin, one of the most selling drugs in the world for cardiovascular disease, was studied theoretically. Density functional theory (DFT) calculations were carried out on the four optical enantiomers ...

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