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Journal of Chemical Information and Modeling|May 23, 2006
logD7.4 modeling using Bayesian Regularized Neural Networks. Assessment and correction of the errors of predictionPierre Bruneau, Nathan R McElroyJournal of Pharmaceutical Sciences|October 30, 2004
Application of ALOGPS to predict 1-octanol/water distribution coefficients, logP, and logD, of AstraZeneca in-house databaseIgor V Tetko, Pierre BruneauJournal of Chemical Information and Modeling|June 2, 2007
A database of historically-observed chemical replacementsDavid Y Haubertin, Pierre BruneauJournal of Chemical Information and Computer Sciences|November 25, 2003
Classification of diverse organic compounds that induce chromosomal aberrations in Chinese hamster cellsNathan R McElroy, E D Thompson, Peter C JursJournal of Medicinal Chemistry|March 7, 2003
QSAR and classification of murine and human soluble epoxide hydrolase inhibition by urea-like compoundsNathan R McElroy, Peter C Jurs, Christophe Morisseau, et al.Journal of Medicinal Chemistry|January 5, 2002
Rational determination of transfer free energies of small drugs across the water-oil interfaceDelphine Bas, Delphine Dorison-Duval, Stéphanie Moreau, et al.Drug Discovery Today|July 19, 2006
Can we estimate the accuracy of ADME-Tox predictions?Igor V Tetko, Pierre Bruneau, Hans-Werner Mewes, et al.Pageof 1