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

Result

polaris/pkis2-egfr-wt-r-1_DGLGraphTransformer_AttentiveFPModel

DGLGraphTransformer + AttentiveFPModel

Submitted on: December 08, 2023ID: 8lYzHmQZVekmdsnheu3dG

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baseline

null model

Contributors

Related benchmark

Detailed Results

Test set	Target label	Metric	Score
test	EGFR	r2	-0.8278921083608826
test	EGFR	pearsonr	0.27088039562661753
test	EGFR	spearmanr	0.1820131717153426
test	EGFR	explained_var	0.006939785310340896
test	EGFR	mean_squared_error	1472.8578315410048
test	EGFR	mean_absolute_error	26.490482705831525