Table 1 R2ADJ, Q2EXT, Q2CV, number of features, and MAE obtained with MLR1, IBK1, and RF1.

From: Searching glycolate oxidase inhibitors based on QSAR, molecular docking, and molecular dynamic simulation approaches

Model ID

Number of features

R2ADJ

MAE

Q2CV

MAECV

Q2EXT

MAEEXT

IBK1

7

0.942

0.270

0.891

0.413

0.907

0.364

MLR1

8

0.915

0.337

0.893

0.383

0.897

0.376

RF1

7

0.987

0.134

0.889

0.382

0.907

0.310