scholarly journals Characterization of Binding Mode of the Heterobiaryl gp120 Inhibitor in HIV-1 Entry: A Molecular Docking and Dynamics Simulation Study

2013 ◽  
Vol 34 (8) ◽  
pp. 2466-2472
Author(s):  
Changdev G. Gadhe ◽  
Gugan Kothandan ◽  
Seung Joo Cho
Keyword(s):  
Molecular Docking ◽  
Simulation Study ◽  
Binding Mode ◽  
Dynamics Simulation ◽  
Molecular Docking And Dynamics ◽  
Hiv 1

Binding mode of chitin and TLR2 via molecular docking and dynamics simulation

2016 ◽  
Vol 42 (11) ◽  
pp. 936-941 ◽  
Author(s):  
Peicheng Shen ◽  
Wenwen Li ◽  
Ying Wang ◽  
Xiao He ◽  
Liqun He
Keyword(s):  
Molecular Docking ◽  
Binding Mode ◽  
Dynamics Simulation ◽  
Molecular Docking And Dynamics

Synthesis, Molecular Docking and Dynamics Simulation Studies of New 7-oxycoumarin Derivatives as Potential Antioxidant Agents

2018 ◽  
Vol 18 (18) ◽  
pp. 1572-1587
Author(s):  
Nehad A. Abdel Latif ◽  
Rasha Z. Batran ◽  
Salwa F. Mohamed ◽  
Mohammed A. Khedr ◽  
Mohamed I. Kobeasy ◽  
...  
Keyword(s):  
Molecular Docking ◽  
Dynamics Simulation ◽  
Simulation Studies ◽  
Antioxidant Agents ◽  
Molecular Docking And Dynamics
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