Understanding the Stabilization of Single-Walled Carbon Nanotubes and Graphene in Ionic Surfactant Aqueous Solutions: Large-Scale Coarse-Grained Molecular Dynamics Simulation-Assisted DLVO Theory

2015 ◽  
Vol 119 (2) ◽  
pp. 1047-1060 ◽  
Author(s):  
Chih-Jen Shih ◽  
Shangchao Lin ◽  
Michael S. Strano ◽  
Daniel Blankschtein
Keyword(s):  
Carbon Nanotubes ◽  
Molecular Dynamics ◽  
Molecular Dynamics Simulation ◽  
Large Scale ◽  
Single Walled Carbon Nanotubes ◽  
Dlvo Theory ◽  
Dynamics Simulation ◽  
Coarse Grained ◽  
Ionic Surfactant ◽  
Walled Carbon Nanotubes

Understanding enzymatic degradation of single-walled carbon nanotubes triggered by functionalization using molecular dynamics simulation

2017 ◽  
Vol 4 (3) ◽  
pp. 720-727 ◽  
Author(s):  
Ming Chen ◽  
Guangming Zeng ◽  
Piao Xu ◽  
Yi Zhang ◽  
Danni Jiang ◽  
...  
Keyword(s):  
Carbon Nanotubes ◽  
Molecular Dynamics ◽  
Molecular Dynamics Simulation ◽  
Horseradish Peroxidase ◽  
Enzymatic Degradation ◽  
Single Walled Carbon Nanotubes ◽  
Dynamics Simulation ◽  
Single Walled Carbon ◽  
Degrading Enzymes ◽  
Walled Carbon Nanotubes

Interactions of SWCNTs with their degrading enzymes (horseradish peroxidase and lactoperoxidase) during biodegradation.

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