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Table 5 The performance of classification models for the computationally picked TCP test set

From: SYBA: Bayesian estimation of synthetic accessibility of organic compounds

Model AUC Acc SN SP Threshold
Default threshold
SYBA 0.903 0.962 0.925 1.000 0.0
SAScore 0.999 0.665 0.999 0.331 6.0
RF 0.995 0.892 0.784 0.999 0.5
Optimized threshold
SYBA 0.998 0.988 0.985 0.991 − 18.6
SAScore 0.999 0.990 0.986 0.993 4.5
SCScore 0.641 0.612 0.499 0.725 3.1
RF 0.995 0.973 0.960 0.986 0.2