Jul 2026
Adapting Evidential Neural Networks to Test-Time Neighbor Fusion Improves Molecular Property Prediction
PG-EVIKAL learns a property-distance metric to re-rank structurally similar neighbors by their property relevance before fusion, building on EVIKAL (scalar Kalman filter) and GP-EVIKAL (Gaussian process variant handling correlated neighbors).
Cameron J. Gruich, Wei-Chi Yao, Yi-Xin Wang et al.
· arXiv.org · 0 citations