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Table 4 Simple tree models

From: Predictive classification models and targets identification for betulin derivatives as Leishmania donovani inhibitors

  

Training

  

Test

Dataset

ROC score

Roc score (cross-validated)

Dataset

ROC score

Dataset 1

(2 Class)

Diverse

1 (20)

2 (21)

0.89

0.62

1 (11)

2 (6)

0.71

R C

1 (25)

2 (17)

0.91

0.62

1 (6)

2 (10)

0.91

Dataset 2

(2 Class from 3)

Diverse

1 (13)

2 (13)

0.91

0.63

1 (9)

2 (4)

0.80

R C

1 (20)

3 (9)

0.94

0.57

1 (2)

3 (8)

0.59

Dattaset 3

(3 Class)

Diverse

1 (13)

2 (15)

3 (13)

0.90

0.65

1 (8)

2 (4)

3 (4)

0.70

R C

1 (20)

2 (13)

3 (9)

0.76

0.54

1 (2)

2 (6)

3 (8)

0.72

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Journal of Cheminformatics

ISSN: 1758-2946

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