Identification of a key element for hydrogen-bonding patterns between protein kinases and their inhibitors. Katayama N, Orita M, Yamaguchi T, Hisamichi H, Kuromitsu S, Kurihara H, Sakashita H, Matsumoto Y, Fujita S, Niimi T.
Showing posts with label Computational. Show all posts
Showing posts with label Computational. Show all posts
Sunday, September 7, 2008
Saturday, August 23, 2008
PDK1 Modeling - University of Kentucky
Combined 3D-QSAR Modeling and Molecular Docking Study on Indolinone Derivatives as Inhibitors of 3-Phosphoinositide-Dependent Protein Kinase-1. Abdulhameed MD, Hamza A, Liu J, Zhan CG.
Selectivity Prediction - Pfizer
Predicting Kinase Selectivity Profiles Using Free-Wilson QSAR Analysis. Sciabola S, Stanton RV, Wittkopp S, Wildman S, Moshinsky D, Potluri S, Xi H.
Wednesday, August 20, 2008
Review of Computational Methods - Cephalon
Knowledge Based Prediction of Ligand Binding Modes and Rational Inhibitor Design for Kinase Drug Discovery. Ghose AK, Herbertz T, Pippin DA, Salvino JM, Mallamo JP.
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