Molecular dynamics simulation of cytotoxicity of graphene nanosheets to blood-coagulation protein

2017 ◽  
Vol 12 (1) ◽  
pp. 01A403 ◽  
Author(s):  
Byeong Cheol Jo ◽  
Hyun Jung Yoon ◽  
Myoung-Ryul Ok ◽  
Sangwook Wu
Keyword(s):  
Molecular Dynamics ◽  
Molecular Dynamics Simulation ◽  
Blood Coagulation ◽  
Graphene Nanosheets ◽  
Dynamics Simulation ◽  
Coagulation Protein

Zn2+ion of the snake venom metalloproteinase (SVMP) plays a critical role in ligand binding: a molecular dynamics simulation study

RSC Advances ◽  
2015 ◽  
Vol 5 (86) ◽  
pp. 70566-70576 ◽  
Author(s):  
Sathishkumar Chinnasamy ◽  
Selvaraman Nagamani ◽  
Karthikeyan Muthusamy
Keyword(s):  
Molecular Dynamics ◽  
Molecular Dynamics Simulation ◽  
Ligand Binding ◽  
Blood Coagulation ◽  
Snake Venom ◽  
Simulation Study ◽  
Tissue Damage ◽  
Critical Role ◽  
Dynamics Simulation ◽  
Snake Venom Metalloproteinase

Snake venom metalloproteinase (SVMP) is one of the major components of snake venom and it is a root causative agent for edema, local tissue damage, inflammation, blood coagulation and hemorrhage during the snake bite.

Abnormal change of melting points of gold nanoparticles confined between two-layer graphene nanosheets

RSC Advances ◽  
2016 ◽  
Vol 6 (110) ◽  
pp. 108343-108346 ◽  
Author(s):  
Gang Wang ◽  
Nanhua Wu ◽  
Jinjian Wang ◽  
Jingling Shao ◽  
Xiaolei Zhu ◽  
...  
Keyword(s):  
Molecular Dynamics ◽  
Gold Nanoparticles ◽  
Molecular Dynamics Simulation ◽  
Melting Temperature ◽  
Graphene Nanosheets ◽  
Dynamics Simulation ◽  
Nanoparticle Size ◽  
Melting Points ◽  
Layer Graphene ◽  
Reasonable Explanation

A molecular dynamics simulation demonstrated that the melting temperature of gold nanoparticles confined in two-layer graphene nanosheets was indicated to decrease with nanoparticle size and a reasonable explanation is provided.

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