3D-QSAR (CoMFA, CoMSIA, HQSAR and topomer CoMFA), MD simulations and molecular docking studies on purinylpyridine derivatives as B-Raf inhibitors for the treatment of melanoma cancer

2019 ◽  
Vol 30 (6) ◽  
pp. 2093-2107 ◽  
Author(s):  
Jaydeepsinh Chavda ◽  
Hardik Bhatt
Keyword(s):  
Molecular Docking ◽  
3D Qsar ◽  
Md Simulations ◽  
Docking Studies ◽  
Topomer Comfa ◽  
Molecular Docking Studies ◽  
Melanoma Cancer

3D-QSAR and Molecular Docking Studies of Flavonoid Derivatives as Potent Acetylcholinesterase Inhibitors

2015 ◽  
Vol 12 (10) ◽  
pp. 837-843 ◽  
Author(s):  
An Zhou ◽  
Zeyu Wu ◽  
Ailing Hui ◽  
Bin Wang ◽  
Xianchun Duan ◽  
...  
Keyword(s):  
Molecular Docking ◽  
Acetylcholinesterase Inhibitors ◽  
3D Qsar ◽  
Docking Studies ◽  
Molecular Docking Studies

3D-QSAR and Molecular Docking Studies of HIV-1 Entry Inhibitors Targeting GP120-CD4 Binding Site

2018 ◽  
Vol 15 (2) ◽  
Author(s):  
Bhumika D. Patel ◽  
Nidhi Choksi ◽  
Kinjal Patel ◽  
Qureshi Gulamnizami
Keyword(s):  
Molecular Docking ◽  
Binding Site ◽  
3D Qsar ◽  
Docking Studies ◽  
Molecular Docking Studies ◽  
Entry Inhibitors ◽  
Cd4 Binding Site ◽  
Hiv 1

3D-QSAR and molecular docking studies on designing inhibitors of the hepatitis C virus NS5B polymerase

2016 ◽  
Vol 1117 ◽  
pp. 227-239 ◽  
Author(s):  
Wenlian Li ◽  
Hongzong Si ◽  
Yang Li ◽  
Cuizhu Ge ◽  
Fucheng Song ◽  
...  
Keyword(s):  
Molecular Docking ◽  
Hepatitis C Virus ◽  
Hepatitis C ◽  
3D Qsar ◽  
Docking Studies ◽  
Molecular Docking Studies ◽  
Ns5b Polymerase
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