Neural Message Passing with Edge Updates for Predicting Properties of Molecules and Materials

Benchmark Model Rank Results
formation-energy-on-materials-projectSchNet-edge-update#4MAE: 22.7
formation-energy-on-materials-projectSchNet#6MAE: 31.8
formation-energy-on-qm9SchNet-edge-update#10MAE: 0.242
formation-energy-on-qm9SchNet#13MAE: 0.314