Search Result "Docking Molecules"


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

Processing of Small Molecule Databases for Automated Docking

Journal: Medicinal Chemistry
Volume: 3 Issue: 1 Year: 2007 Page: 107-113
Author(s): Maxwell D. Cummings, Alan C. Maxwell, Renee L. DesJarlais

Methods for Docking Small Molecules to Macromolecules: A User’s Perspective. 1. The Theory

Journal: Current Pharmaceutical Design
Volume: 20 Issue: 20 Year: 2014 Page: 3338-3359
Author(s): Nathanael Weill,Eric Therrien,Valerie Campagna-Slater,Nicolas Moitessier

Modeling Reality for Optimal Docking of Small Molecules to Biological Targets

Journal: Current Computer-Aided Drug Design
Volume: 5 Issue: 4 Year: 2009 Page: 241-263
Author(s): Christopher R. Corbeil, Eric Therrien, Nicolas Moitessier

Methods for Docking Small Molecules to Macromolecules: A User’s Perspective. 2. Applications

Journal: Current Pharmaceutical Design
Volume: 20 Issue: 20 Year: 2014 Page: 3360-3372
Author(s): Valerie Campagna-Slater,Eric Therrien,Nathanael Weill,Nicolas Moitessier

Molecular Docking Algorithms

Journal: Current Drug Targets
Volume: 9 Issue: 1 Year: 2008 Page: 1040-1047
Author(s): Raquel Dias, Walter Filgueira de Azevedo Jr.

Review Article

Advances in the Treatment of Explicit Water Molecules in Docking and Binding Free Energy Calculations

Journal: Current Medicinal Chemistry
Volume: 26 Issue: 42 Year: 2019 Page: 7598-7622
Author(s): Xiao Hu,Irene Maffucci,Alessandro Contini

Review Article

Advances in Docking

Journal: Current Medicinal Chemistry
Volume: 26 Issue: 42 Year: 2019 Page: 7555-7580
Author(s): Vladimir B. Sulimov,Danil C. Kutov,Alexey V. Sulimov

Docking: Successes and Challenges

Journal: Current Pharmaceutical Design
Volume: 11 Issue: 3 Year: 2005 Page: 323-333
Author(s): Venkatraman Mohan, Alan C. Gibbs, Maxwell D. Cummings, Edward P. Jaeger, Renee L. DesJarlais

Conotoxins: Review and Docking Studies to determine potentials of Conotoxin as an Anticancer Drug Molecule

Journal: Current Topics in Medicinal Chemistry
Volume: 12 Issue: 8 Year: 2012 Page: 845-851
Author(s): Kirtan Dave,Anasuya Lahiry

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