MolLedger: An Additive Graph Neural Network with Chemically Grounded ADME Attributions
cs.LG
Submitted: 2026-08-31
Updated: 2026-09-24
Code: https://github.com/cxji/molledger
Terminology
Sources
- The Interpretable and Effective Graph Neural Additive Networks
- NODE-GAM: Neural Generalized Additive Model for Interpretable Deep Learning
- Ligandformer: A Graph Neural Network for Predicting Compound Property with Robust Interpretation
- Strategies for Pre-training Graph Neural Networks
- Therapeutics Data Commons: Machine Learning Datasets and Tasks for Drug Discovery and Development
- How Powerful are Graph Neural Networks?
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