Machine Learning Models to Predict Inhibition of the Bile Salt Export Pump

Kevin McLoughlin, Claire G. Jeong, Thomas D. Sweitzer, Amanda J. Minnich, Margaret Tse, Brian J. Bennion, Jonathan E. Allen, Stacie Calad-Thomson, Tom Rush, Jim Brase. Machine Learning Models to Predict Inhibition of the Bile Salt Export Pump. Journal of Chemical Information and Computer Sciences, 61(2):587-602, 2021. [doi]

Abstract

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