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The Antiviral Competition ResultsSee the results of the Polaris competition, organized by ASAP Discovery and OpenADMET.

Benchmark

Relevant benchmarks

A benchmark wraps a dataset with additional meta-data to turn it into a machine-learning task. Importantly, the meta-data specifies the evaluation logic, such as the split and metrics to use.

Graphic - Benchmark
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(157 benchmarks total)

tdcommons/cyp2d6-veith
Single TaskClassification
Split: 10,504 / 2,6262024-07-22
tdcommons/cyp2c9-veith
Single TaskClassification
Split: 9,673 / 2,4192024-07-22
tdcommons/ppbr-az
Single TaskRegression
Split: 2,231 / 5592024-07-22
molecularml/moleculeace-chembl4005-ki
Single TaskRegression
Split: 767 / 1932024-07-24
molecularml/moleculeace-chembl264-ki
Single TaskRegression
Split: 2,288 / 5742024-07-24
polaris/pkis1-kit-wt-mut-reg-v3
Multi TaskRegression
Split: 278 / 882024-07-30
polaris/pkis1-kit-wt-mut-cls-v3
Multi TaskClassification
Split: 278 / 882024-07-30
polaris/pkis1-ret-wt-mut-reg-v3
Multi TaskRegression
Split: 280 / 862024-07-30
polaris/pkis2-lok-slk-ood-reg-v2
Multi TaskRegression
Split: 513 / 1272024-09-10
molecularml/moleculeace-chembl2971-ki
Single TaskRegression
Split: 779 / 1972024-07-24
polaris/pkis1-ret-wt-mut-cls-v3
Multi TaskClassification
Split: 280 / 862024-07-30
polaris/pkis2-kit-wt-cls-v3
Single TaskClassification
Split: 524 / 1162024-07-30
polaris/pkis2-egfr-wt-cls-v3
Single TaskClassification
Split: 496 / 1442024-07-30
biogen/adme-fang-reg-v2
Multi TaskRegression
Split: 2,816 / 7052024-07-30
biogen/adme-fang-solu-reg-v2
Single TaskRegression
Split: 1,578 / 4002024-07-30
biogen/adme-fang-hppb-reg-v2
Single TaskRegression
Split: 126 / 342024-07-30
molecularml/moleculeace-chembl237-ki
Single TaskRegression
Split: 2,081 / 5222024-07-24
polaris/pkis2-kit-wt-ood-eg-v2
Single TaskRegression
Split: 530 / 1102024-09-10
polaris/pkis2-kit-wt-ood-cls-v2
Single TaskClassification
Split: 530 / 1102024-09-10
cwognum/chembl1862-ki
Single TaskRegression
Split: 633 / 1612024-05-12

Showing 101 to 120 of 157 benchmarks

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