Search Result "Glide XP"
Assessing the Performance of GOLD, Glide and MM-GBSA on a Datasetof Hydrazide-hydrazone-based Tuberculostatics
Journal: Letters in Drug Design & Discovery
Volume: 20 Issue: 10 Year: 2023 Page: 1557-1568
Author(s):
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
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
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: 12 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
Exploring Human 5HT1A/2A Receptor Through Homology Modeling and FlexibleDocking Studies for the Binding Hotspot of Substituted 2,4-imidazolidinedioneand Oxazolidinedione Derivatives
Journal: Current Indian Science
Volume: 1 Issue: 1 Year: 2023 Page: 1-18
Author(s):
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
In silico Studies Toward the Discovery of Novel Type-II Inhibitors of TrkA: Pharmacophore-based 3D-QSAR Modeling, Database Screening and Molecular Docking
Journal: Letters in Drug Design & Discovery
Volume: 13 Issue: 6 Year: 2016 Page: 526-538
Author(s): Yahui Tian,Lu Zhou,Xiaoli Li,Suwen Zhou,Rong Yong,Liangliang Zhong
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
3D Structure Generation, Molecular Dynamics and Docking Studies of IRHOM2 Protein Involved in Cancer & Rheumatoid Arthritis
Journal: Current Computer-Aided Drug Design
Volume: 11 Issue: 4 Year: 2015 Page: 325-335
Author(s): Utkarsh Raj,Himansu Kumar,Pritish Kumar Varadwaj
Design and Synthesis of Some Novel Estrogen Receptor Modulators as Anti-Breast Cancer Agents: In Vitro & In Vivo Screening, Docking Analysis
Journal: Anti-Cancer Agents in Medicinal Chemistry
Volume: 16 Issue: 11 Year: 2016 Page: 1461-1467
Author(s): Pritam N. Dube,Santosh N. Mokale