Nitrogen doped nanographene structures; study on the adsorption of nucleobases, nucleotides, and their triphosphate derivatives using mixed docking, MD, and QM/MM approaches.

  • Rahim Ghadari
  • Published 2017 in The Journal of chemical physics

Abstract

The interactions of the nucleobases, nucleotides, and their triphosphate derivatives in both neutral and anionic forms with the nitrogen doped graphenes (NG) were studied using docking and molecular dynamic simulation methods. In docking studies, based on binding energy results, the anionic species and nucleobases were showing the most and the least… (More)
DOI: 10.1063/1.4974088

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Cite this paper

@article{Ghadari2017NitrogenDN, title={Nitrogen doped nanographene structures; study on the adsorption of nucleobases, nucleotides, and their triphosphate derivatives using mixed docking, MD, and QM/MM approaches.}, author={Rahim Ghadari}, journal={The Journal of chemical physics}, year={2017}, volume={146 4}, pages={044105} }