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Table 1 Truth table for 5-fold cross-validation of the Scripps IC50 FCFP_6 and BCI models

From: Predicting cytotoxicity from heterogeneous data sources with Bayesian learning

 

Scripps IC50 FCFP_6 Model

Scripps IC50 BCI Model

Experiment

Cytotoxic

Non-toxic

Cytotoxic

Non-toxic

Cytotoxic

21 ± 1.5%

16 ± 1.6%

20 ± 3.7%

17 ± 3.7%

Non-toxic

18 ± 0.9%

45 ± 0.9%

20 ± 2.1%

43 ± 2.1%