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Papers Benchmarks Datasets Tasks

MolBench dataset and benchmarks · SOTA2 Research

Research Datasets

MolBench

Benchmarks

Task NameDataset NameSOTA MethodSort

Task NameDataset NameSOTA ResultTrendResults

Molecular Docking Screening

MolBench-MS

80Average Hits@3

13

Binding Affinity Comparison

MolBench-MS

81.1Accuracy

13

Molecular Property Filtering

MolBench-MS

98Accuracy

13

Molecule Optimization for Physicochemical Properties

MolBench-MO

0Delta

13

Molecule Editing

MolBench-MO Molecule Editing (39 tasks)

100Accuracy

13

Popular tasks

Molecule Editing Molecule Optimization for Physicochemical Properties Molecular Property Filtering Binding Affinity Comparison Molecular Docking Screening

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