Guidelines for Method ComparisonRead the first pre-print from the Small Molecule Steering Committee

Result

polaris/adme-fang-HCLint-1_DGLGraphTransformer_AttentiveFPModel

DGLGraphTransformer + AttentiveFPModel

Submitted on: December 08, 2023ID: qRlgx6VBT8kLJ0W9Rv6vv

Quick Links

Tags

baseline

null model

Contributors

Related benchmark

Detailed Results

Test set	Target label	Metric	Score
test	LOG_HLM_CLint	r2	0.17414443983003325
test	LOG_HLM_CLint	pearsonr	0.4217750611485627
test	LOG_HLM_CLint	spearmanr	0.43182466421657717
test	LOG_HLM_CLint	explained_var	0.17718196047495893
test	LOG_HLM_CLint	mean_squared_error	0.32077050284951786
test	LOG_HLM_CLint	mean_absolute_error	0.47340309180941026