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

Result

polaris/adme-fang-HPPB-1_atompair_RandomForestRegressor

atompair + RandomForestRegressor

Submitted on: December 08, 2023ID: Z8iTT4ZjTSGTl9M0cdZW2

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baseline

null model

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Detailed Results

Test set	Target label	Metric	Score
test	LOG_HPPB	r2	0.45020075688924877
test	LOG_HPPB	pearsonr	0.6895847393511394
test	LOG_HPPB	spearmanr	0.6787378734760331
test	LOG_HPPB	explained_var	0.470470297177937
test	LOG_HPPB	mean_squared_error	0.33297971952873057
test	LOG_HPPB	mean_absolute_error	0.4993914545375817