Molecular dynamics simulation of electric field driven water and heavy metals transport through fluorinated carbon nanotubes

2019 ◽  
Vol 278 ◽  
pp. 658-671 ◽  
Author(s):  
Abbas Panahi ◽  
Ali Shomali ◽  
Mohammad Hossein Sabour ◽  
Ebrahim Ghafar-Zadeh
Keyword(s):  
Heavy Metals ◽  
Carbon Nanotubes ◽  
Molecular Dynamics ◽  
Molecular Dynamics Simulation ◽  
Electric Field ◽  
Dynamics Simulation ◽  
Fluorinated Carbon

scholarly journals The transport of a charged peptide through carbon nanotubes under an external electric field: a molecular dynamics simulation

RSC Advances ◽  
2021 ◽  
Vol 11 (38) ◽  
pp. 23589-23596
Author(s):  
Wen Li ◽  
Shun Cheng ◽  
Bin Wang ◽  
Zheng Mao ◽  
Jianhua Zhang ◽  
...  
Keyword(s):  
Carbon Nanotubes ◽  
Molecular Dynamics ◽  
Carbon Nanotube ◽  
Molecular Dynamics Simulation ◽  
Electric Field ◽  
External Electric Field ◽  
Dynamics Simulation

The role of electric field and types of carbon nanotube influencing the delivery process of peptide through CNTs were studied via all-atom molecular dynamics simulation.

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