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Papers Benchmarks Datasets Tasks

NMRShiftDB2 dataset and benchmarks · SOTA2 Research

Research Datasets

NMRShiftDB2

Benchmarks

Task NameDataset NameSOTA MethodSort

Task NameDataset NameSOTA ResultTrendResults

1H NMR chemical shift prediction

NMRShiftDB2 Latom

0.158MAE

7

13C NMR chemical shift prediction

NMRShiftDB2 Lmol

0.777MAE

2

Popular tasks

1H NMR chemical shift prediction 13C NMR chemical shift prediction

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