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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)

polaris/pkis1-egfr-wt-mut-r-1
Multi TaskRegression
Split: 290 / 742023-12-08
polaris/pkis1-egfr-wt-mut-reg-v2
Multi TaskRegression
Split: 290 / 762024-05-31
tdcommons/cyp3a4-veith
Single TaskClassification
Split: 9,861 / 2,4672024-07-22
molecularml/moleculeace-chembl237-ec50
Single TaskRegression
Split: 762 / 1932024-07-24
polaris/pkis1-kit-wt-mut-r-1
Multi TaskRegression
Split: 277 / 872023-12-08
polaris/pkis1-kit-wt-mut-reg-v2
Multi TaskRegression
Split: 278 / 882024-05-31
molecularml/moleculeace-chembl3979-ec50
Single TaskRegression
Split: 899 / 2262024-07-24
polaris/molprop-250k-leadlike-r-1
Multi TaskRegression
Split: 202,184 / 47,8162023-12-08
polaris/adme-fang-hclint-1
Single TaskRegression
Split: 2,229 / 5752023-12-08
andrew/example-dataset
Single TaskRegression
Split: 1 / 12024-07-22
molecularml/moleculeace-chembl238-ki
Single TaskRegression
Split: 839 / 2132024-07-24
molecularml/moleculeace-chembl239-ec50
Single TaskRegression
Split: 1,374 / 3472024-07-24
lu-valencelabs/my-test
Single TaskClassification
Split: 9,861 / 2,4672024-07-26
tdcommons/solubility-aqsoldb
Single TaskRegression
Split: 7,985 / 1,9972024-07-22
polaris/pkis1-ret-wt-mut-r-1
Multi TaskRegression
Split: 279 / 852023-12-08
molecularml/moleculeace-chembl204-ki
Single TaskRegression
Split: 2,201 / 5532024-07-24
molecularml/moleculeace-chembl2047-ec50
Single TaskRegression
Split: 503 / 1282024-07-24
polaris/pkis1-kit-wt-mut-cls-v2
Multi TaskClassification
Split: 278 / 882024-05-31
polaris/pkis1-ret-wt-mut-reg-v2
Multi TaskRegression
Split: 280 / 862024-05-31
molecularml/moleculeace-chembl214-ki
Single TaskRegression
Split: 2,651 / 6662024-07-24

Showing 81 to 100 of 157 benchmarks

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