ResearchBenchmarksMolecular Energy Prediction on QM9 50000 samplesMolecular Energy Prediction on QM9 50000 samplesFollow0.354MAEHIP-NN0.348560.385280.4220.45872Sep 29, 2017Evaluation resultsMethodMethodLinksMAEHIP-NNN_train + N_validate=5...N_train + N_validate=500002017.090.354MTMN_train + N_validate=5...N_train + N_validate=500002017.090.41SchNetN_train + N_validate=5...N_train + N_validate=500002017.090.49