Exploring QSAR for Antimalarial Activities and Drug Distribution within Blood of a Series of 4-Aminoquinoline Drugs Using Genetic-MLR

Table 11

Evaluation of the prediction ability of the MLR models in the external validation set for 3D7 and W2 strains.

	Training set				Test set
Log (1/IC50)	𝑅^2	𝑅^2adj	RMSE	𝐹	𝑅^2pred	RMSE
3D7	0.93	0.89	0.15	23.86	0.96	0.18
W2	0.96	0.93	0.14	38.38	0.90	0.28