Evidential meta-model for molecular property prediction.
Journal:
Bioinformatics (Oxford, England)
Published Date:
Oct 3, 2023
Abstract
MOTIVATION: The usefulness of supervised molecular property prediction (MPP) is well-recognized in many applications. However, the insufficiency and the imbalance of labeled data make the learning problem difficult. Moreover, the reliability of the predictions is also a huddle in the deployment of MPP models in safety-critical fields.