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Medicinal chemistry / Pharmacology / Cheminformatics / Computational chemistry / Quantitative structure–activity relationship / Pharmacy / K-nearest neighbor algorithm / Cross-validation / Root-mean-square deviation / Pharmaceutical sciences / Chemistry / Science


A k-NN Algorithm for Predicting Oral Sub-Chronic Toxicity in the Rat Domenico Gadaleta 1,2, Fabiola Pizzo 1, Anna Lombardo 1, Angelo Carotti 2, Sylvia E. Escher 3, Orazio Nicolotti 2 and Emilio Benfenati 1 1
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