Maedeh Kamel

Assessment of the adsorption mechanism of Flutamide anticancer drug on the functionalized single-walled carbon nanotube surface as a drug delivery vehicle: An alternative theoretical approach based on DFT and MD

Maedeh Kamel, ‪Heidar Raissi, Ali Morsali et al. · Applied Surface Science · 2017 · 108 citations

Adsorption Mechanism, Nanomedicine, Chemical Engineering +12

Theoretical study of solvent and co-solvent effects on the interaction of Flutamide anticancer drug with Carbon nanotube as a drug delivery system

Maedeh Kamel, ‪Heidar Raissi, Ali Morsali · Journal of Molecular Liquids · 2017 · 67 citations

Nanomedicine, Theoretical Study, Flutamide Anticancer Drug +7

Theoretical insights into the intermolecular and mechanisms of covalent interaction of Flutamide drug with COOH and COCl functionalized carbon nanotubes: A DFT approach

Maedeh Kamel, Ali Morsali, ‪Heidar Raissi et al. · SHILAP Revista de lepidopterología · 2020 · 51 citations · Full text

Engineering, Molecule-based Material, Computational Chemistry +18

Theoretical elucidation of the amino acid interaction with graphene and functionalized graphene nanosheets: insights from DFT calculation and MD simulation

Maedeh Kamel, ‪Heidar Raissi, Hassan Hashemzadeh et al. · Amino Acids · 2020 · 39 citations

Graphene Nanomeshes, Amino Acid Interaction, Engineering +11

Comprehensive theoretical prediction of the stability and electronic properties of hydroxyurea and carmustine drugs on pristine and Chitosan-functionalized graphitic carbon nitride in vacuum and aqueous environment

Maedeh Kamel, Marziyeh Mohammadi, Kamal Mohammadifard et al. · Vacuum · 2022 · 31 citations

Chemical Engineering, Engineering, Carbon-based Material +7