Search Result "protein-ligand docking."


Explicit Treatment of Water Molecules in Protein-Ligand Docking

Journal: Current Computer-Aided Drug Design
Volume: 5 Issue: 3 Year: 2009 Page: 145-154
Author(s): Oscar Villacanas, Sergio Madurga, Ernest Giralt, Ignasi Belda

Scope and Limitation of Ligand Docking: Methods, Scoring Functions and Protein Targets

Journal: Current Computer-Aided Drug Design
Volume: 1 Issue: 3 Year: 2005 Page: 275-306
Author(s): L. David, P. Aadal Nielsen, M. Hedstrom, B. Norden

Scoring Functions for Protein-Ligand Docking

Journal: Current Protein & Peptide Science
Volume: 7 Issue: 5 Year: 2006 Page: 407-420
Author(s):

Ligand-Protein Docking: Cancer Research at the Interface between Biology and Chemistry

Journal: Current Medicinal Chemistry
Volume: 10 Issue: 9 Year: 2003 Page: 763-777
Author(s): R. C. Glen, S. C. Allen

Protein-ligand Docking: A Review of Recent Advances and Future Perspectives

Journal: Current Pharmaceutical Analysis
Volume: 4 Issue: 1 Year: 2008 Page: 1-19
Author(s): Gerard Pujadas, Montserrat Vaque, Anna Ardevol, Cinta Blade, M. Josepa Salvado, Mayte Blay, Juan Fernandez-Larrea, Lluis Arola

Post-Docking Optimization and Analysis of Protein-Ligand Interactions of Estrogen Receptor Alpha using AMMOS Software

Journal: Current Computer-Aided Drug Design
Volume: 9 Issue: 1 Year: 2013 Page: 83-94
Author(s): Tania Pencheva, Dessislava Jereva, Maria A. Miteva, Ilza Pajeva

Review Article

Protein-Ligand Docking Simulations with AutoDock4 Focused on the Main Protease of SARS-CoV-2

Journal: Current Medicinal Chemistry
Volume: 28 Issue: 0 Year: 2021 Page: 1-20
Author(s): Walter Filgueira de Azevedo Junior,Gabriela Bitencourt-Ferreira,Joana Retzke Godoy,Hilda Mayela Aran Adriano,Wallyson André dos Santos Bezerra,Alexandra Martins dos Santos Soares

Post Processing of Protein-Compound Docking for Fragment-Based Drug Discovery (FBDD): In-Silico Structure-Based Drug Screening and Ligand-Binding Pose Prediction

Journal: Current Topics in Medicinal Chemistry
Volume: 10 Issue: 6 Year: 2010 Page: 680-694
Author(s): Yoshifumi Fukunishi

Molecular Docking Studies

Ebook: Quick Guideline for Computational Drug Design

Volume: 1 Year: 2018
Author(s): Sheikh Arslan Sehgal,Rana Adnan Tahir,A. Hammad Mirza,Asif Mir
Doi: 10.2174/97816810860331180101

Biologically Active Ligands for Yersinia Outer Protein H (YopH): Feature Based Pharmacophore Screening, Docking and Molecular Dynamics Studies

Journal: Combinatorial Chemistry & High Throughput Screening
Volume: 17 Issue: 7 Year: 2014 Page: 579-595
Author(s): Thangaraju Tamilvanan, Waheeta Hopper

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