scholarly journals A Structural Model of Glycosylated Neuraminidase Based on Molecular Dynamics Simulations for Virtual Inhibitor Screening Against Influenza Virus

2012 ◽  
Vol 33 (3) ◽  
pp. 1059-1062 ◽  
Author(s):  
Young-Jin Choi ◽  
Chan-Ho Kwon ◽  
Eun-Ae Cho ◽  
In-Cheol Kang ◽  
Hyun-Ja Jeong ◽  
...  
Keyword(s):  
Molecular Dynamics ◽  
Influenza Virus ◽  
Molecular Dynamics Simulations ◽  
Structural Model ◽  
Inhibitor Screening ◽  
Dynamics Simulations

scholarly journals A modified random network model for P2O5–Na2O–Al2O3–SiO2 glass studied by molecular dynamics simulations

RSC Advances ◽  
2021 ◽  
Vol 11 (12) ◽  
pp. 7025-7036
Author(s):  
Yaxian Zhao ◽  
Jincheng Du ◽  
Xin Cao ◽  
Chong Zhang ◽  
Gang Xu ◽  
...  
Keyword(s):  
Molecular Dynamics ◽  
Molecular Dynamics Simulations ◽  
Network Model ◽  
Structural Model ◽  
Random Network ◽  
Sio2 Glass ◽  
Sodium Aluminosilicate ◽  
Aluminosilicate Glasses ◽  
Dynamics Simulations ◽  
Glass Compositions

(A) A modified structural model proposed for P2O5-bearing sodium aluminosilicate glasses. (B) Degree of preferred connection (DPC) of different T–O–T network linkage for LAP, MAP and HAP glass compositions with various P2O5 content.

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