Table 2: Performance of Bayesian and recursive partitioning models and their 5-fold cross-validation results.

ModelTPFNFPTNSESPMCCQ+Q

NB-a10913522352060.9690.9590.8740.8300.993
NB-b111982154080.9930.9960.9850.9820.999
NB-c74931645550370.7040.9170.5910.6220.941
NB-d1054117554160.9900.9860.9530.9330.998
RP-a1113135153790.9880.9910.9660.9560.998
RP-b1111154953810.9870.9910.9660.9580.997
RP-c10075717753140.9460.9680.8760.8500.989
RP-d1022429553960.9600.9830.9250.9150.992

Note: NB-a: NB model with MOE 2D descriptors; NB-b: NB model with MOE 2D descriptors + ECFP_6; NB-c: NB model with DS 2D descriptors; NB-d: NB model with DS 2D descriptors + ECFP_6; RP-a: RP model with MOE 2D descriptors; RP-b: RP model with MOE 2D descriptors + ECFP_6; RP-c: RP model with DS 2D descriptors; RP-d: RP model with DS 2D descriptors + ECFP_6.