Density Functional Theory Adsorption of Atoms on Cytosine
نویسندگان
چکیده
منابع مشابه
Exploration of the adsorption of caffeine molecule on the TiO2 nanostructures: A density functional theory study
The first principles were calculated to study the adsorption behaviors of caffeine molecules on the pristineand N-doped TiO2 anatase nanoparticles. Both oxygen and nitrogen in the caffeine molecule can reactstrongly with TiO2 nanoparticle. Thus, the binding sites were located on the oxygen or nitrogen atom ofthe caffeine, while the binding site of the TiO2 nanoparticle occurs ...
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ژورنال
عنوان ژورنال: Malaysian Journal of Science
سال: 2010
ISSN: 1394-3065
DOI: 10.22452/mjs.vol29no1.10