MoTSE: an interpretable task similarity estimator for small molecular property prediction tasks
Han Li, Xinyi Zhao, Shuya Li, Fang Wan, Dan Yang Zhao, Jianyang Zeng
MoTSE estimates task similarity for molecular property prediction to improve transfer learning performance by leveraging graph neural networks and interpretability.
bioRxiv · Jan 13, 2021 · PreprintBioinformatics