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Fig. 2 | Journal of Cheminformatics

Fig. 2

From: Assessing the calibration in toxicological in vitro models with conformal prediction

Fig. 2

Calibration and efficiency plot. The dark lines show the mean error rate for the active (dark red) and inactive (dark blue) compounds. For a well-calibrated model, the error rate ideally follows the dashed diagonal line. The light coloured lines illustrate the mean efficiencies expressed as ratio of single label sets for the active (light red) and inactive (light blue) compounds. The shaded areas indicate the respective standard deviations within the fivefold CV. Class 0: inactive compounds, class 1: active compounds

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