Search Result "docking"


Linear Interaction Energy (LIE) Method in Lead Discovery and Optimization

Journal: Current Drug Targets
Volume: 9 Issue: 1 Year: 2008 Page: 1100-1105
Author(s): Hermes Luis Neubauer de Amorim, Rafael Andrade Caceres, Paulo Augusto Netz

Computational Methods for Calculation of Ligand-Binding Affinity

Journal: Current Drug Targets
Volume: 9 Issue: 1 Year: 2008 Page: 1031-1039
Author(s): Walter Filgueira de Azevedo Jr., Raquel Dias

Application of Drug Repositioning Strategy to TOFISOPAM

Journal: Current Medicinal Chemistry
Volume: 15 Issue: 3 Year: 2008 Page: 3196-3203
Author(s): P. Bernard, C. Dufresne-Favetta, P. Favetta, Q.-T. Do, F. Himbert, S. Zubrzycki, T. Scior, C. Lugnier

Pharmacophore-Based Virtual Screening

Journal: Current Medicinal Chemistry
Volume: 15 Issue: 1 Year: 2008 Page: 1018-1024
Author(s): Hongmao Sun

In Silico-In Vitro Screening of Protein-Protein Interactions: Towards the Next Generation of Therapeutics

Journal: Current Pharmaceutical Biotechnology
Volume: 9 Issue: 2 Year: 2008 Page: 103-122
Author(s): Bruno O. Villoutreix, Karine Bastard, Olivier Sperandio, Robin Fahraeus, Jean-Luc Poyet, Fabien Calvo, Benoit Deprez, Maria A. Miteva

Binding of Tris to Bacillus licheniformis α-Amylase Can Affect Its Starch Hydrolysis Activity

Journal: Protein & Peptide Letters
Volume: 15 Issue: 2 Year: 2008 Page: 212-214
Author(s): Zahra Ghalanbor, Nasser Ghaemi, Sayed-Amir Marashi, Massoud Amanlou, Mehran Habibi-Rezaei, Khosro Khajeh, Bijan Ranjbar, Yau Sang Chan, Jack Ho Wong, Tzi Bun Ng

Inhibition of Inflammation by a p38 MAP Kinase Targeted Cell Permeable Peptide

Journal: Medicinal Chemistry
Volume: 4 Issue: 6 Year: 2008 Page: 597-604
Author(s): Jing Fu, Xianmei Meng, Junyun He, Jun Gu

Pharmacokinetic and Pharmacodynamic Predictions of Novel Potential HIV-1 Integrase Inhibitors

Journal: Drug Metabolism Letters
Volume: 2 Issue: 4 Year: 2008 Page: 256-260
Author(s): C.H. T.P. da Silva, V.B. da Silva, C. A. Taft

Calculating the Protonation States of Proteins and Small Molecules: Implications to Ligand-Receptor Interactions

Journal: Current Computer-Aided Drug Design
Volume: 4 Issue: 3 Year: 2008 Page: 169-179
Author(s): Rooplekha Mitra, Radhey Shyam, Indranil Mitra, Maria A. Miteva, Emil Alexov

Molecular Modeling of Two CYP2C19 SNPs and Its Implications for Personalized Drug Design

Journal: Protein & Peptide Letters
Volume: 15 Issue: 1 Year: 2008 Page: 27-32
Author(s): Dong-Qing Wei, Jing-Fang Wang, Chao Chen, Yixue Li, Kuo-Chen Chou

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