Search Result "binding free energy (Ebinding)"


Computer Aided Drug Design Strategies Used in the Discovery of Fructose 1, 6-Bisphosphatase Inhibitors

Journal: Current Pharmaceutical Design
Volume: 11 Issue: 3 Year: 2005 Page: 283-294
Author(s): M. Rami Reddy, Mark D. Erion

Review Article

Usefulness of Molecular Modeling in Characterizing the Ligand-Binding Sites of Proteins: Experience with Human PDI, PDIp and COX

Journal: Current Medicinal Chemistry
Volume: 20 Issue: 31 Year: 2013 Page: 3840-3854
Author(s): Pan Wang,Bao-Ting Zhu

Research Article

In vitro and In silico: Selectivities of Seychellene Compound as Candidate Cyclooxygenase Isoenzyme Inhibitor on Pre-Osteoblast Cells

Journal: Current Enzyme Inhibition
Volume: 13 Issue: 1 Year: 2017 Page: 2-10
Author(s): Sentot J. Raharjo,Chanif Mahdi,Nurdiana Nurdiana,Takheshi Kikuchi,Fatchiyah Fatchiyah

Conformational Changes in HIV-1 Reverse Transcriptase Induced by Nonnucleoside Reverse Transcriptase Inhibitor Binding

Journal: Current HIV Research
Volume: 2 Issue: 4 Year: 2004 Page: 323-332
Author(s): Nicolas Sluis-Cremer, N. Alpay Temiz, Ivet Bahar

Docking and Molecular Dynamics Study on the Inhibitory Activity of Novel Inhibitors on Epidermal Growth Factor Receptor (EGFR)

Journal: Medicinal Chemistry
Volume: 7 Issue: 1 Year: 2011 Page: 24-31
Author(s): Qing-Hua Liao, Qing-Zhi Gao, Jing Wei, Kuo-Chen Chou

A Comparative Study of Drug Resistance Mechanism Associated with Active Site and Non-Active Site Mutations: I388N and D425G Mutants of Acetyl-Coenzyme-A Carboxylase

Journal: Current Computer-Aided Drug Design
Volume: 8 Issue: 1 Year: 2012 Page: 62-69
Author(s): Xiao-Lei Zhu, Guang-Fu Yang

Assault on Resistance: The Use of Computational Chemistry in the Development of Anti-HIV Drugs

Journal: Current Pharmaceutical Design
Volume: 12 Issue: 1 Year: 2006 Page: 1843-1856
Author(s): Marilyn B.K. Smith, Richard H. Smith, Jr., William L. Jorgensen

Research Article

Inhibitory Activity Against Epidermal Growth Factor Receptor (EGFR) Based on Single Point Mutations of Active Site Residues

Journal: Medicinal Chemistry
Volume: 10 Issue: 3 Year: 2014 Page: 252-270
Author(s): Petar M. Mitrasinovic

Established and Emerging Fluorescence-Based Assays for G-Protein Function: Heterotrimeric G-Protein Alpha Subunits and Regulator of G-Protein Signaling (RGS) Proteins

Journal: Combinatorial Chemistry & High Throughput Screening
Volume: 6 Issue: 4 Year: 2003 Page: 399-407
Author(s): Randall J. Kimple, Miller B. Jones, Adam Shutes, Benjamin R. Yerxa, David P. Siderovski, Francis S. Willard

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

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