Search Result "docking"


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

Receptor Flexibility in Ligand Docking and Virtual Screening

Ebook: Young People’s Visions of the World

Volume: 1 Year: 2010
Author(s): Maria A. Miteva,Charles H. Robert,Jean Didier Marechal,David Perahia
Doi: 10.2174/97816080514271110101

Virtual Docking: How Are We Doing And How Can We Improve?

Ebook: Young People’s Visions of the World

Volume: 3 Year: 2010
Author(s): Renee L. DesJarlais,Maxwell D. Cummings,Alan C. Gibbs
Doi: 10.2174/97816080520111070301

In Silico Ligand-Receptor Docking of Potentially Selective Butyrylcholinesterase Inhibitors Structurally Related to the Marine Natural Product Debromoflustramine B

Journal: Medicinal Chemistry
Volume: 6 Issue: 3 Year: 2010 Page: 141-143
Author(s): Miguel O. Mitchell, Robert W. Figliozzi, Mustafa Guzel

Inhibition Kinetics of Flavonoids on Yeast α-Glucosidase Merged with Docking Simulations

Journal: Protein & Peptide Letters
Volume: 17 Issue: 1 Year: 2010 Page: 1270-1279
Author(s): Heng Xu

QSAR, Docking, and CoMFA Studies of GSK3 Inhibitors

Journal: Current Pharmaceutical Design
Volume: 16 Issue: 2 Year: 2010 Page: 2666-2675
Author(s): Isela Garcia, Yagamare Fall, Generosa Gomez

Development of a Web Service for the Investigation of Complexation by Cyclodextrins

Journal: Letters in Drug Design & Discovery
Volume: 7 Issue: 3 Year: 2010 Page: 200-207
Author(s): Zsolt Bikadi, Istvan Hazai, Laszlo Demko, Peter Hari, Eszter Hazai

Biochemical and Docking Analysis of Substrate Interactions with Polyisoprenylated Methylated Protein Methyl Esterase

Journal: Current Cancer Drug Targets
Volume: 10 Issue: 6 Year: 2010 Page: 634-648
Author(s): R. Duverna, S.Y. Ablordeppey, N.S. Lamango

Kinetics and Docking Studies of a COX-2 Inhibitor Isolated from Terminalia bellerica Fruits

Journal: Protein & Peptide Letters
Volume: 17 Issue: 1 Year: 2010 Page: 1251-1257
Author(s): Tamatam Chandramohan Reddy, Polamarasetty Aparoy, Neela Kishore Babu, Kotha Anil Kumar, Suresh Kumar Kalangi, Pallu Reddanna

Studies of Benzothiadiazine Derivatives as Hepatitis C Virus NS5B Polymerase Inhibitors Using 3D-QSAR, Molecular Docking and Molecular Dynamics

Journal: Current Medicinal Chemistry
Volume: 17 Issue: 2 Year: 2010 Page: 2788-2803
Author(s): X. Wang, W. Yang, X. Xu, H. Zhang, Y. Li, Y. Wang

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