3D-QSAR and molecular docking studies of 4-anilinoquinazoline derivatives: a rational approach to anticancer drug design

Molecular Diversity ◽

10.1007/s11030-009-9137-9 ◽

2009 ◽

Vol 14 (1) ◽

pp. 27-38 ◽

Author(s):

Sisir Nandi ◽

Manish C. Bagchi

Keyword(s):

Molecular Docking ◽

Drug Design ◽

Anticancer Drug ◽

3D Qsar ◽

Docking Studies ◽

Rational Approach ◽

Molecular Docking Studies

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A comparative QSAR analysis and molecular docking studies of quinazoline derivatives as tyrosine kinase (EGFR) inhibitors: A rational approach to anticancer drug design

Journal of Saudi Chemical Society ◽

10.1016/j.jscs.2011.04.017 ◽

2013 ◽

Vol 17 (4) ◽

pp. 361-379 ◽

Author(s):

Malleshappa N. Noolvi ◽

Harun M. Patel

Keyword(s):

Molecular Docking ◽

Drug Design ◽

Tyrosine Kinase ◽

Anticancer Drug ◽

Docking Studies ◽

Egfr Inhibitors ◽

Rational Approach ◽

Molecular Docking Studies ◽

Qsar Analysis ◽

Quinazoline Derivatives

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Computer aided drug design based on 3D-QSAR and molecular docking studies of 5-(1H-indol-5-yl)-1,3,4-thiadiazol-2-amine derivatives as PIM2 inhibitors: a proposal to chemists

In Silico Pharmacology ◽

10.1007/s40203-018-0043-7 ◽

2018 ◽

Vol 6 (1) ◽

Author(s):

Adnane Aouidate ◽

Adib Ghaleb ◽

Mounir Ghamali ◽

Samir Chtita ◽

Abdellah Ousaa ◽

...

Keyword(s):

Molecular Docking ◽

Drug Design ◽

3D Qsar ◽

Docking Studies ◽

Computer Aided Drug Design ◽

Molecular Docking Studies ◽

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Pharmacophore model prediction, 3D-QSAR and molecular docking studies on vinyl sulfones targeting Nrf2-mediated gene transcription intended for anti-Parkinson drug design

Journal of Biomolecular Structure and Dynamics ◽

10.1080/07391102.2015.1077343 ◽

2015 ◽

Vol 34 (6) ◽

pp. 1282-1297 ◽

Author(s):

Mohd Athar ◽

Mohsin Yousuf Lone ◽

Vijay M. Khedkar ◽

Prakash Chandra Jha

Keyword(s):

Molecular Docking ◽

Drug Design ◽

Gene Transcription ◽

Model Prediction ◽

Pharmacophore Model ◽

3D Qsar ◽

Docking Studies ◽

Molecular Docking Studies

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3D-QSAR modeling and molecular docking studies on a series of triazole analogues as antibacterial agents

Журнал структурной химии ◽

10.26902/jsc20180705 ◽

2018 ◽

Vol 59 (7) ◽

Keyword(s):

Molecular Docking ◽

Antibacterial Agents ◽

3D Qsar ◽

Docking Studies ◽

Qsar Modeling ◽

Molecular Docking Studies

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3D-QSAR Analysis and Molecular Docking Studies on 3-Arylcoumarin Derivatives as Potential α- Glucosidase Inhibitors

10.37421/mccr.2020.10.548 ◽

2020 ◽

Vol 10 (6) ◽

Author(s):

Gupta K ◽

Tuteja JS

Keyword(s):

Molecular Docking ◽

3D Qsar ◽

Docking Studies ◽

Molecular Docking Studies ◽

Qsar Analysis ◽

Glucosidase Inhibitors

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

Letters in Drug Design & Discovery ◽

10.2174/1570180812666150514233543 ◽

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

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

Anti-Infective Agents ◽

10.2174/2211352515666170809151958 ◽

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 ◽

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Molecular structure, spectroscopic (IR, Raman, NMR, UV–vis) and molecular docking studies of an anticancer drug: isoDC81

Materials Today Proceedings ◽

10.1016/j.matpr.2021.07.190 ◽

2021 ◽

Author(s):

Gargi Tiwari ◽

Abhishek Kumar ◽

Dipendra Sharma

Keyword(s):

Molecular Structure ◽

Molecular Docking ◽

Anticancer Drug ◽

Docking Studies ◽

Molecular Docking Studies

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ChemInform Abstract: 3D QSAR and Molecular Docking Studies of Benzimidazole Derivatives as Hepatitis C Virus NS5B Polymerase Inhibitors.

10.1002/chin.200818210 ◽

2008 ◽

Vol 39 (18) ◽

Author(s):

Pallav D. Patel ◽

Maulik R. Patel ◽

Neerja Kaushik-Basu ◽

Tanaji T. Talele

Keyword(s):

Molecular Docking ◽

Hepatitis C Virus ◽

Hepatitis C ◽

3D Qsar ◽

Docking Studies ◽

Benzimidazole Derivatives ◽

Molecular Docking Studies ◽

Polymerase Inhibitors ◽

Ns5b Polymerase

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

Journal of Molecular Structure ◽

10.1016/j.molstruc.2016.03.073 ◽

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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