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Published in 2020 at "Journal of Computational Chemistry"
DOI: 10.1002/jcc.26216
Abstract: Density functional theory methods were employed to clarify the adsorption/desorption behaviors of the thioneācontaining mercaptopurine and thioguanine drugs on the gold surface using both small Au6 and Au8 clusters as model reactants. Structural features, thermodynamic…
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Keywords:
containing mercaptopurine;
gold clusters;
gold;
mercaptopurine thioguanine ... See more keywords