Structure-Activity Relationship for Fe(III)-Salen-Like Complexes as Potent Anticancer Agents
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چکیده
منابع مشابه
Structure-Activity Relationship for Fe(III)-Salen-Like Complexes as Potent Anticancer Agents
Quantitative structure activity relationship (QSAR) for the anticancer activity of Fe(III)-salen and salen-like complexes was studied. The methods of density function theory (B3LYP/LANL2DZ) were used to optimize the structures. A pool of descriptors was calculated: 1497 theoretical descriptors and quantum-chemical parameters, shielding NMR, and electronic descriptors. The study of structure and...
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ژورنال
عنوان ژورنال: The Scientific World Journal
سال: 2014
ISSN: 2356-6140,1537-744X
DOI: 10.1155/2014/745649