TDC.VDss_Lombardo Leaderboard

Dataset Summary

Dataset Unit Size Task Metric Dataset Split
TDC.VDss_Lombardo L/kg 1,130 Regression Spearman Scaffold

Leaderboard

Rank Model Contact Link #Params Spearman
1 MapLight + GNN Jim Notwell Github, Paper N/A 0.713 ± 0.007
2 MapLight Jim Notwell Github, Paper N/A 0.707 ± 0.009
3 ChemFM Feiyang Cai Github, Paper 26.0M 0.662 ± 0.013
4 CFA Nan Jiang Github, Paper N/A 0.628 ± 0.023
5 Basic ML Nilavo Boral Github, Paper N/A 0.627 ± 0.01
6 Euclia ML model Euclia Github, Paper 50 0.609 ± 0.014
7 SimGCN Suman Kalyan Bera Github, Paper 1,103,000 0.582 ± 0.031
8 RDKit2D + MLP (DeepPurpose) Kexin Huang Github, Paper 633,409 0.561 ± 0.025
9 AttrMasking Kexin Huang Github, Paper 2,067,053 0.559 ± 0.019
10 DeepMol (AutoML) DeepMol Team Github, Paper N/A 0.497 ± 0.011
11 Morgan + MLP (DeepPurpose) Kexin Huang Github, Paper 1,477,185 0.493 ± 0.011
12 Chemprop Kyle Swanson Github, Paper N/A 0.491 ± 0.046