Search Result "GLIDE"

Research Article

Performance Evaluation of Docking Programs- Glide, GOLD, AutoDock & SurflexDock, Using Free Energy Perturbation Reference Data: A Case Study of Fructose-1, 6-bisphosphatase-AMP Analogs

Journal: Mini-Reviews in Medicinal Chemistry
Volume: 20 Issue: 1 Year: 2020 Page: 1179-1187
Author(s): K. Kumar Reddy,R.S. Rathore,P. Srujana,R.R. Burri,C. Ravikumar Reddy,M. Sumakanth,Pallu Reddanna,M. Rami Reddy

In silico Designing and Screening of Lead Compounds to NS5-Methyltransferase of Dengue Viruses

Journal: Medicinal Chemistry
Volume: 7 Issue: 6 Year: 2011 Page: 655-662
Author(s): Dakshinamurthy Sivakumar, Thirunavukkarasu Sivaraman

Research Article

Molecular Docking Studies of Novel Thiosemicarbazone-based Indoles as Potential PI3Kα Inhibitors

Journal: Letters in Drug Design & Discovery
Volume: 14 Issue: 1 Year: 2017 Page: 1252-1258
Author(s): Dima A. Sabbah, Kamal Sweidan

Research Article

Kaempferol as a Potential PAK4 Inhibitor in Triple Negative Breast Cancer: Extra Precision Glide Docking and Free Energy Calculation

Journal: Current Drug Discovery Technologies
Volume: 17 Issue: 5 Year: 2020 Page: 682-695
Author(s): Michael A. Arowosegbe,Oluwamuyiwa T. Amusan,Segun A. Adeola,Oluwatosin B. Adu,Israel A. Akinola,Bimpe F. Ogungbe,Olaposi I. Omotuyi,Gbemisola M. Saibu,Adewale J. Ogunleye,Ramon I. Kanmodi,Nekabari E. Lugbe,Oluwafemi J. Ogunmola,Damilola C. Ajayi,Sedoten O. Ogun,Faith O. Oyende,Ahmed O. Bello,Peter G. Ishola,Patrick E. Obasieke

Identification of Novel β3-Adrenoceptor Agonists Using Energetic Analysis, Structure Based Pharmacophores and Virtual Screening

Journal: Combinatorial Chemistry & High Throughput Screening
Volume: 15 Issue: 8 Year: 2012 Page: 623-640
Author(s): Parul Tewatia, B.K. Malik, Shakti Sahi

Computer-Aided Drug Design of Pyranopyrazoles and Related Compounds for Checkpoint Kinase-1

Journal: Letters in Drug Design & Discovery
Volume: 6 Issue: 8 Year: 2009 Page: 579-584
Author(s): Rahul Ramtekkar, Kandhasamy Kumarvel, Gnanasambandam Vasuki, K. Sekar, R. Krishna

Research Article

Benzoin Schiff Bases: Design, Synthesis, and Biological Evaluation as Potential Antitumor Agents

Journal: Medicinal Chemistry
Volume: 14 Issue: 7 Year: 2018 Page: 695-708
Author(s): Dima A. Sabbah,Fatima Al-Tarawneh,Wamidh H. Talib,Kamal Sweidan,Sanaa K. Bardaweel,Eveen Al-Shalabi,Haizhen A. Zhong,Ghassan Abu Sheikha,Reema Abu Khalaf,Mohammad S. Mubarak

Research Article

Pyrazole Substituted 9-Anilinoacridines as HER2 Inhibitors Targeting Breast Cancer - An In-Silico Approach

Journal: Current Drug Research Reviews
Volume: 13 Issue: 0 Year: 2021 Page: 1-12
Author(s): Kalirajan Rajagopal,Vulsi Bodhya Sri,Gowramma Byran,Swaminathan Gomathi

Homology Modeling and Docking Studies of Cold Shock Protein Homologs (Isoforms) of E. coli

Journal: Current Proteomics
Volume: 11 Issue: 4 Year: 2014 Page: 281-288
Author(s): Amit Kumar, Mahejibin Khan

Use of a kinesin-cro Fusion Protein as the Nanoshuttle to Transport Specific DNA

Journal: Current Nanoscience
Volume: 8 Issue: 5 Year: 2012 Page: 669-675
Author(s): Ming-Chieh Tsai, Jui-Yu Wu, Hsiu-Chen Lin, Tso-Hsiao Chen, Yu-Hui Hsieh, Chwen-Ming Shih, Wen- Yih Chen, Rong-Nan Huang, Tai-Chih Kuo

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