Search Result "Molecular Docking 3D-QSAR"


Molecular Docking and 3D-QSAR Studies on Quinolone-based HDAC Inhibitors

Journal: Letters in Drug Design & Discovery
Volume: 13 Issue: 7 Year: 2016 Page: 577-586
Author(s): Yi Bi, Zeyun Liu, Xianxuan Liu, Xiaochen Zhang, Jing Lu

Research Article

Design of Novel Chemotherapeutic Agents Targeting Checkpoint Kinase 1 Using 3D-QSAR Modeling and Molecular Docking Methods

Journal: Current Computer-Aided Drug Design
Volume: 12 Issue: 4 Year: 2016 Page: 302-313
Author(s): Anand Balupuri, Pavithra K. Balasubramanian, Seung J. Cho

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

Journal: Letters in Drug Design & Discovery
Volume: 12 Issue: 10 Year: 2015 Page: 837-843
Author(s): An Zhou,Zeyu Wu,Ailing Hui,Bin Wang,Xianchun Duan,Haixiang Wang,Jian Pan

Research Article

Computational Investigations of Coumarin Derivatives as CyclindependentKinase 9 Inhibitors Using 3D-QSAR, Molecular Docking andMolecular Dynamics Simulation

Journal: Current Computer-Aided Drug Design
Volume: 18 Issue: 5 Year: 2022 Page: 363-380
Author(s):

Prediction of Binding Affinities for Hydroxamic Acid Derivatives as Urease Inhibitors by Molecular Docking and 3D-QSAR Studies

Journal: Letters in Drug Design & Discovery
Volume: 6 Issue: 2 Year: 2009 Page: 93-100
Author(s): Zaheer-ul-Haq, Abdul Wadood

Current State and Perspectives of 3D-QSAR

Journal: Current Topics in Medicinal Chemistry
Volume: 2 Issue: 1 Year: 2002 Page: 1381-1394
Author(s): Miki Akamatsu

Research Article

Computational Screening of CCR5 Inhibitors as Potential Entry Inhibitor Microbicides Using 3D-QSAR Studies, Docking and Molecular Dynamics Simulation

Journal: Current HIV Research
Volume: 15 Issue: 4 Year: 2017 Page: 234-244
Author(s): Radhika Ramachandran,Muthusankar Aathi,Durairaj D. Ruban,Shanmughavel Piramanyagam

Research Article

Discovery of Novel Lysine Methyltransferase (SMYD3) Inhibitors byUtilizing 3D-QSAR, Molecular Docking and Molecular Dynamics Simulation

Journal: Letters in Drug Design & Discovery
Volume: 21 Issue: 10 Year: 2024 Page: 1728-1744
Author(s):

Pharmacophore Modeling, 3D-QSAR and Molecular Docking of Furanochalcones as Inhibitors of Monoamine Oxidase-B

Journal: Central Nervous System Agents in Medicinal Chemistry
Volume: 16 Issue: 2 Year: 2016 Page: 105-111
Author(s): Bijo Mathew,Sanal Dev,Jerad Suresh,Githa E. Mathew,Baskar Lakshmanan,Abitha Haridas,Fajeelath Fathima,Girish K. Krishnan

Research Article

Topomer CoMFA 3D-QSAR and Docking Studies of Pyrimidine Inhibitors of Pneumocystis Carinii Dihydrofolate Reductase

Journal: Letters in Drug Design & Discovery
Volume: 13 Issue: 1 Year: 2016 Page: 1055-1062
Author(s): Jianbo Tong, Pei Zhan, Tuanli Yao, Lanbing Ma, Min Bai

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