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

Result

polaris/pkis2-ret-wt-r-1_estate_FCModel

estate + FCModel

Submitted on: December 08, 2023ID: uyq2eXaRMWPfqtfZl5QGZ

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baseline

null model

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Detailed Results

Test set	Target label	Metric	Score
test	RET	r2	-0.6854552433630146
test	RET	pearsonr	0.38666044618212
test	RET	spearmanr	0.3832280230816139
test	RET	explained_var	0.041317937471669564
test	RET	mean_squared_error	2001.318125750131
test	RET	mean_absolute_error	30.238195217428903