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Ionization energy (Eib) prediction on polymer electronic property dataset (test)
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0.406
RMSE (eV)
Periodic-TDL
0.39344
0.47822
0.563
0.64778
May 26, 2026
RMSE (eV)
Updated 7d ago
Evaluation Results
Method
Method
Links
RMSE (eV)
Periodic-TDL
Pre-training=PI1M data...
2026.05
0.406
polyBERT
Architecture=sequence-...
2026.05
0.443
TransPolymer
Architecture=sequence-...
2026.05
0.454
MMPolymer
Architecture=multimoda...
2026.05
0.493
TransChem
Architecture=multimoda...
2026.05
0.504
MolCLR (GIN)
Architecture=graph-bas...
2026.05
0.549
MolCLR (GCN)
Architecture=graph-bas...
2026.05
0.55
Periodic-TDL
Pre-training=PI1M data...
2026.05
0.554
MolCLR (GIN)
Architecture=graph-bas...
2026.05
0.564
MolCLR (GCN)
Architecture=graph-bas...
2026.05
0.573
polyBERT
Architecture=sequence-...
2026.05
0.574
polyGNN
Architecture=graph-bas...
2026.05
0.577
polyGNN
Architecture=graph-bas...
2026.05
0.584
TransPolymer
Architecture=sequence-...
2026.05
0.589
MMPolymer
Architecture=multimoda...
2026.05
0.606
TransChem
Architecture=multimoda...
2026.05
0.637
Morgan (NN)
Architecture=fingerpri...
2026.05
0.642
Morgan (NN)
Architecture=fingerpri...
2026.05
0.72
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