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Benchmarks
Molecular Property Regression on ZINC12k (test)
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0.064
MAE
GPS
0.06004
0.08677
0.1135
0.14023
Oct 13, 2024
MAE
Updated 1d ago
Evaluation Results
Method
Method
Links
MAE
GPS
augmentation=OGE-Aug
2024.10
0.064
Specformer
2024.10
0.066
GINE
augmentation=OGE-Aug
2024.10
0.066
GIN
positional_encoding=SPE
2024.10
0.069
GPS
2024.10
0.07
CIN
2024.10
0.079
GNN-AK+
2024.10
0.08
GIN
positional_encoding=Si...
2024.10
0.085
KP-GIN+
2024.10
0.119
Graphormer
2024.10
0.122
SAN
2024.10
0.139
GIN
positional_encoding=PEG
2024.10
0.144
GIN
positional_encoding=Ba...
2024.10
0.155
GIN
2024.10
0.163
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