MolAI: A Deep Learning Framework for Data-driven Molecular Descriptor Generation and Advanced Drug Discovery Applications
Sayyed Jalil Mahdizadeh, Leif Axel Eriksson
This paper introduces MolAI, a deep learning model for generating molecular descriptors, which improves drug discovery tasks like ADMET prediction and virtual screening.
Journal of Chemical Information and Modeling · Sep 15, 2025Peer-reviewedBioinformatics