TDC.PPBR_AZ Leaderboard

Dataset Summary

Dataset Unit Size Task Metric Dataset Split
TDC.PPBR_AZ % 1,797 Regression MAE Scaffold

Leaderboard

Rank Model Contact Link #Params MAE
1 MapLight + GNN Jim Notwell Github, Paper N/A 7.526 ± 0.106
2 MapLight Jim Notwell Github, Paper N/A 7.66 ± 0.058
3 Chemprop Kyle Swanson Github, Paper N/A 7.788 ± 0.21
4 BaseBoosting KyQVZ6b2 David Huang Github, Paper N/A 7.914 ± 0.096
5 DeepMol (AutoML) DeepMol Team Github, Paper N/A 7.99 ± 0.104
6 Chemprop-RDKit Kyle Swanson Github, Paper N/A 8.288 ± 0.173
7 Innoplexus ADME Rohit Yadav Github, Paper N/A 8.582 ± 0.036
8 CFA Nan Jiang Github, Paper N/A 8.68 ± 0.262
9 Basic ML Nilavo Boral Github, Paper N/A 9.185 ± 0.0
10 NeuralFP Kexin Huang Github, Paper 480,193 9.292 ± 0.384
11 AttentiveFP Kexin Huang Github, Paper 300,806 9.373 ± 0.335
12 ContextPred Kexin Huang Github, Paper 2,067,053 9.445 ± 0.224