Search Result "Flexibledocking"


Research Article

Integrating Multiple Receptor Conformation Docking and Multi Dimensional QSAR for Enhancing Accuracy of Binding Affinity Prediction

Journal: Current Computer-Aided Drug Design
Volume: 13 Issue: 2 Year: 2017 Page: 127-142
Author(s): Vangala Radhika,Hassan A. Jaraf,Sivan S. Kanth,Manga Vijjulatha

Research Article

Amlodipine Ocular Delivery Restores Ferning Patterns and ReducesIntensity of Glycosylated Peak of Carrageenan-Induced Tear Fluid: AnIn-Silico Flexible Docking with IL-Β1

Journal: Current Drug Delivery
Volume: 21 Issue: 10 Year: 2024 Page: 1375-1385
Author(s): Rudra Narayan Sahoo,Sandeep Kumar Swain,Amit Kumar Nayak

Molecular Simulation to Investigate the Cofactor Specificity for Pichia stipitis Xylose Reductase

Journal: Medicinal Chemistry
Volume: 9 Issue: 7 Year: 2013 Page: 985-992
Author(s): Xiao-Le Xia,Shan Cong,Xiao-Rong Weng,Jin-Hua Chen,Jing-Fang Wang,Kuo-Chen Chou

Research Article

A-RFP: An Adaptive Residue Flexibility Prediction Method Improving Protein-ligand Docking Based on Homologous Proteins

Journal: Current Bioinformatics
Volume: 19 Issue: 10 Year: 2024 Page: 908-918
Author(s):

Neutrophil Elastase as a Target in Lung Cancer: the State of the Art

Ebook: Advances in Cancer Drug Targets
Volume: 3 Year: 2016
Author(s): Gautier Moroy,Alain J.P. Alix,Janos Sapi,William Hornebeck,Erika Bourguet
Doi: 10.2174/9781681082332116030003

Role of Ensemble Conformational Sampling Using Molecular Docking & Dynamics in Drug Discovery

Ebook: Frontiers in Computational Chemistry
Volume: 6 Year: 2022
Author(s):
Doi: 10.2174/9789815036848122060004

Hierarchical Docking of Databases of Multiple Ligand Conformations

Journal: Current Topics in Medicinal Chemistry
Volume: 5 Issue: 8 Year: 2005 Page: 739-749
Author(s): David M. Lorber, Brian K. Shoichet

Review Article

Recent Advancements and SAR Studies of Synthetic Coumarins asMAO-B Inhibitors: An Updated Review

Journal: Mini-Reviews in Medicinal Chemistry
Volume: 24 Issue: 20 Year: 2024 Page: 1834-1846
Author(s): Naresh Kumar Rangra

Review Article

Computational and Synthetic Target-based Approaches to the Discovery of Novel Anticonvulsant Compounds

Journal: Current Medicinal Chemistry
Volume: 28 Issue: 33 Year: 2021 Page: 6866-6894
Author(s): Melisa Edith Gantner,Manuel Augusto Llanos,Federico Mariano Garofalo,María Luisa Villalba,Luciana Gavernet

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