Hello.I work with gussian software .my project topic is theoritical calculation adsorption anti cancer drug on nanotube carbon .please guide me.
Hi .. see this research as it may be of help to you@
Hi,
please find below some bibliography regarding to DFT calculation
Article Investigation of heavy metal atoms adsorption onto graphene ...
- J. Phys. Chem. A 2003, 107, 4184-4195 (
10.1021/jp0225774 CCC)
Article Interaction between polysaccharide monomer and SiO2/Al2O3/Ca...
doi: 10.5004/dwt.2020.25737
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