Structure Simulation of Cisplatin Complexes with Single-Walled Carbon Nanotubes and Fullerenol
2019 ◽
Vol 18
(03n04)
◽
pp. 1940011
Keyword(s):
Structure and energy calculations of modified complexes of single-walled carbon nanotubes and fullerenol C[Formula: see text](OH)[Formula: see text] with cisplatin have been performed using the quantum chemical method at the DFT/B3LYP/SV/Lanl2DZ level. The nanotubes were modified with COOH groups at the end and sidewall of the nanotube and cisplatin molecules. The dependence of their structure on the presence of a solvent was established.
2013 ◽
Vol 51
(2)
◽
pp. 137-144
2016 ◽
Vol 12
(4)
◽
pp. 405-410
◽
2012 ◽
Vol 2
(2)
◽
pp. 200-209
◽