Browsing by Author "Karahan, Ozlem"
A computational study on the amine-oxidation mechanism of monoamine oxidase: Insight into the polar nucleophilic mechanism Authors : Sağ Erdem, Safiye; Karahan, Ozlem; Yıldız, İbrahim; Yelekci, Kemal
Publisher and Date : (ROYAL SOC CHEMISTRY, 2006)The proposed polar nucleophilic mechanism of MAO was investigated using quantum chemical calculations employing the semi-empirical PM3 method. In order to mimic the reaction at the enzyme's active site the reactions between ...
Thermal rearrangement of 2-acetoxy-266-trimethylbicyclo[3.1.0]hexane: Theoretical elucidation of the mechanism Authors : Erdem, Safiye Sag; Uyar, Fahriye; Karahan, Ozlem; Yelekci, Kemal
Publisher and Date : (Elsevier Science, 2007)Bicyclohexenes are believed to be the immediate precursors of aromatic compounds. As a part of the exploratory study of thermal aromatization reactions 266-trimethylbicyclo[3.1.0]hexan-2-ol and its ester derivative ...