Table 7.

Performance of physicochemical descriptor classifier on an independent test data.

Cluster #	ACC	ERR	MCC	PER	SEN	SPE	FN	FP	TP	TN
cluster-0	100	0	1	100	100	100	0	0	3	30
cluster-1	97	0.03	0.851	100	75	100	1	0	3	29
cluster-2	100	0	1	100	100	100	0	0	3	30
cluster-3	97	0.03	0	0	0	100	1	0	0	32
cluster-4	100	0	1	100	100	100	0	0	2	31
cluster-5	97	0.03	0.909	100	86	100	1	0	6	26
cluster-6	100	0	1	100	100	100	0	0	3	30
cluster-7	100	0	1	100	100	100	0	0	3	30
cluster-8	97	0.03	0.851	100	75	100	1	0	3	29
cluster-9	100	0	1	100	100	100	0	0	1	32
cluster-10	97	3.03	0.696	50	100	97	0	1	1	31
cluster-11	97	3.03	0.696	50	100	97	0	1	1	31
Overall	97.98	1.02	0.8678	87.88	87.88	98.90	-	-	-	-

ACC: accuracy, ERR: error, MCC: Matthews Correlation Coefficient, PER: Precision, SEN: Sensitivity, SPE: Specificity, FN: False Negatives, FP: False Positives, TP: True Positives, TN: True Negatives.