Search Result "AutoDock"
A New Scoring Function for Molecular Docking Based on AutoDock and AutoDock Vina
Journal: Current Drug Discovery Technologies
Volume: 12 Issue: 3 Year: 2015 Page: 170-178
Author(s): Vsevolod Yu. Tanchuk,Volodymyr O. Tanin,Andriy I. Vovk,Gennady Poda
Virtual Screening of NCI Diversity Set II Lead to New Cyclin-Dependent Kinases 5 Inhibitors Using AutoDock
Journal: Letters in Drug Design & Discovery
Volume: 13 Issue: 3 Year: 2016 Page: 234-242
Author(s): Siripit Pitchuanchom,Chavi Yenjai,Chantana Boonyarat,Stefano Forli,Arthur J. Olson
Rational Drug Discovery of HCV Helicase Inhibitor: Improved Docking Accuracy with Multiple Seeding in AutoDock Vina and In Si tu Minimization
Journal: Current Computer-Aided Drug Design
Volume: 13 Issue: 2 Year: 2017 Page: 160-169
Author(s): See K. Lim,Rozana Othman,Rohana Yusof,Choon H. Heh
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
Docking Analysis of Deltamethrin Pesticide with MHC I and MHC IIMolecules to Establish Immunomodulation Effects
Journal: Current Signal Transduction Therapy
Volume: 18 Issue: 2 Year: 2023 Page: 60-67
Author(s):
Water Molecules Increases Binding Affinity of Natural PI3Kγ Inhibitors Against Cancer
Journal: Current Computer-Aided Drug Design
Volume: 11 Issue: 4 Year: 2015 Page: 304-320
Author(s): Pooja Sharma,Aparna Shukla,Komal Kalani,Vijaya Dubey,Santosh Kumar Srivastava,Suaib Luqman,Feroz Khan
Convolutional Neural Network-based Virtual Screening
Journal: Current Medicinal Chemistry
Volume: 28 Issue: 10 Year: 2021 Page: 2033-2047
Author(s): Wenying Shan,Xuanyi Li,Hequan Yao,Kejiang Lin
Molecular Insights into the Interaction of Ursolic Acid and Cucurbitacin from Colocynth with Therapeutic Targets of Mycobacterium tuberculosis
Journal: Letters in Drug Design & Discovery
Volume: 17 Issue: 10 Year: 2020 Page: 1309-1318
Author(s): Mohammad Ajmal Ali,Mohammad Abul Farah,Joongku Lee,Khalid M. Al-Anazi,Fahad M.A. Al-Hemaid
Virtual Screening for the Development of Dual-Inhibitors Targeting Topoisomerase IB and Tyrosyl-DNA Phosphodiesterase 1
Journal: Current Drug Targets
Volume: 18 Issue: 5 Year: 2017 Page: 544-555
Author(s): Francesca Cardamone,Simone Pizzi,Federico Iacovelli,Mattia Falconi,Alessandro Desideri
In Silico Screening of Some Anti-Cancer Drugs Against the Main Proteaseof COVID-19 Using Molecular Docking
Journal: Letters in Organic Chemistry
Volume: 20 Issue: 1 Year: 2023 Page: 77-90
Author(s):