Open access
Oct 2026
QSAR Models for Non-Effective Levels of Chemical Substances Using the CORAL Software
A comparative analysis shows that incorporating the CII significantly improves model performance: the average coefficient of determination (R2) for the validation set increased, underscoring the advantage of this approach, and a similar improvement occurs on the calibration set.
A. Toropov, A. Toropova, E. Benfenati
· Environments · 0 citations