Quantum mechanics property prediction on D-B-A Oligomer Photostability Dataset (test)
0.927R^2 (HOMOm1 (eV))FARM
Evaluation results
| Method | Links | |||||||||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| FARMEvaluation protocol=frozen feature extractor, Prediction head=GRU, Number of runs=102024.10 | 0.927 | 0.895 | 0.928 | 0.877 | 0.837 | 0.877 | 0.938 | 0.922 | 0.755 | 0.995 | 0.929 | 0.925 | 0.9 | 0.921 | 0.905 | 0.936 | 0.948 | 0.911 | 0.919 | 0.924 | 0.839 | 0.868 | 0.815 | 0.895 | 0.919 |