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Table 3 Statistical results of the seven classification models for the cluster fivefold cross-validated training set

From: ADMET evaluation in drug discovery. 20. Prediction of breast cancer resistance protein inhibition through machine learning

 Training set (cluster fivefold cross-validation)
GABAMCCAUC
SVM0.9100.9010.8100.954
DNN0.9050.8970.7940.949
XGBoost0.9050.8970.8000.959
SGB0.9010.8920.7910.956
RLR0.8790.8760.7480.935
k-NN0.8670.8630.7220.918
NB0.8190.8230.6340.896