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. 2020 May 20;12:35. doi: 10.1186/s13321-020-00439-2

Table 5.

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

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