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Paper

Receptor- and ligand-based study of fullerene analogues: comprehensive computational approach including quantum-chemical, QSAR and molecular docking simulations

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a
Interdisciplinary Center for Nanotoxicity, Department of Chemistry and Biochemistry, Jackson State University, 1400 J.R. Lynch Street, P.O. Box 17910, Jackson, USA
E-mail: rasulev@icnanotox.org;
Fax: +1-601-979-6865 ;
Tel: +1-601-979-3723
b
Department of Civil and Environmental Engineering, Jackson State University, 1400 J.R. Lynch Street, P.O. Box 17068, Jackson, USA
Org. Biomol. Chem., 2013,11, 5798-5808

DOI: 10.1039/C3OB40878G
Received 28 Apr 2013, Accepted 02 Jul 2013
First published online 05 Jul 2013
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