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

A Structural Model for Apolipoprotein C-II Amyloid Fibrils: Experimental Characterization and Molecular Dynamics Simulations

2011 ◽  
Vol 405 (5) ◽  
pp. 1246-1266 ◽  
Author(s):  
Chai Lean Teoh ◽  
Chi L.L. Pham ◽  
Nevena Todorova ◽  
Andrew Hung ◽  
Craig N. Lincoln ◽  
...  
Keyword(s):  
Molecular Dynamics ◽  
Molecular Dynamics Simulations ◽  
Amyloid Fibrils ◽  
Structural Model ◽  
Experimental Characterization ◽  
Apolipoprotein C ◽  
Dynamics Simulations

scholarly journals Molecular Dynamics Simulations of the Influenza Virus Envelope and Raft-Like Aggregates of Hemagglutinin

2012 ◽  
Vol 102 (3) ◽  
pp. 297a
Author(s):  
Daniel L. Parton ◽  
Alex Tek ◽  
Marc Baaden ◽  
Mark S.P. Sansom
Keyword(s):  
Molecular Dynamics ◽  
Influenza Virus ◽  
Molecular Dynamics Simulations ◽  
Virus Envelope ◽  
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.

New Structural Model of PANI/CSA Conducting Polymer System Obtained by Molecular Dynamics Simulations

2015 ◽  
Vol 24 (4) ◽  
pp. 284-290 ◽  
Author(s):  
Maciej Śniechowski ◽  
Remigiusz Borek ◽  
Konrad Piwowarczyk ◽  
Wojciech Łużny
Keyword(s):  
Molecular Dynamics ◽  
Molecular Dynamics Simulations ◽  
Conducting Polymer ◽  
Structural Model ◽  
Polymer System ◽  
Dynamics Simulations
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