Critical evaluation of feature importance assessment in FFNN-based models for predicting Kamlet-Taft parameters

Mohan et al. developed a feed-forward neural network (FFNN) model to predict Kamlet-Taft parameters using quantum chemically derived features, achieving notable predictive accuracy. However, this study raises concerns about conflating prediction accuracy with feature importance accuracy, as high R2...

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Bibliographic Details
Main Author: Yoshiyasu Takefuji
Format: Article
Language:English
Published: KeAi Communications Co. Ltd. 2025-09-01
Series:Green Chemical Engineering
Subjects:
Online Access:http://www.sciencedirect.com/science/article/pii/S2666952825000032
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