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ANI dataset and benchmarks · SOTA2 Research

Research Datasets

ANI

Benchmarks

Task NameDataset NameSOTA MethodSort

Task NameDataset NameSOTA ResultTrendResults

DFT energy prediction

ANI-Al

0.082MAE (Config, eV)

13

Molecule Generation

ANI-1x

98.23Validity

2

Molecular Energy and Force Prediction

ANI-1x

0.301Energy MAE

2

Popular tasks

Molecular energy and force prediction DFT energy prediction Molecule Generation

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