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Papers Benchmarks Datasets Tasks

Phenotype-guided Molecular Generation research benchmarks · SOTA2 Research

Phenotype-guided Molecular Generation

Benchmarks

Dataset NameSOTA MethodSort

Dataset NameSOTA methodMetricTrendResultsLast Updated

RCSB PDB and DTC Target: EGFR

-7.37Affinity (pKd/pKi)

8

Apr 20, 2026

RCSB PDB and DTC Target: TP53

-7.01Affinity

8

Apr 20, 2026

RCSB PDB and DTC Target: SMAD3

-5.16Affinity

8

Apr 20, 2026

RCSB PDB and DTC Target: PIK3CA

-2.88Affinity

8

Apr 20, 2026

RCSB PDB and DTC Target: MTOR

-6.67Affinity

8

Apr 20, 2026

RCSB PDB and DTC Target: HDAC1

-1.84Affinity

8

Apr 20, 2026

RCSB PDB and DTC Target: CTSK

-5.33Affinity

8

Apr 20, 2026

RCSB PDB and DTC Target AURKB

-2.31Affinity

8

Apr 20, 2026

RCSB PDB and DTC Target: AKT2

-6.99Affinity

8

Apr 20, 2026

RCSB PDB and DTC Target: AKT1

-6.49Affinity

8

Apr 20, 2026

Popular datasets

RCSB PDB and DTC

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