Datasets:
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README.md
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>>> AttentiveSkin
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AttentiveSkin
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DatasetDict({
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### Use a dataset to train a model
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One way to use the dataset is through the [MolFlux](https://exscientia.github.io/molflux/) package developed by Exscientia.
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First, from the command line, install `MolFlux` library with `catboost` and `rdkit` support
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>>> AttentiveSkin
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AttentiveSkin
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DatasetDict({
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test: Dataset({
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features: ['Name', 'Synonym', 'CAS RN', 'GHS', 'Detailed Page', 'Evidence', 'OECD TG 404', 'Data Source', 'Frequency', 'SMILES', 'SMILES URL', 'SMILES Source', 'Canonical SMILES', 'Split', 'ClusterNo', 'MolCount', 'group'],
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num_rows: 803
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})
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train: Dataset({
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features: ['Name', 'Synonym', 'CAS RN', 'GHS', 'Detailed Page', 'Evidence', 'OECD TG 404', 'Data Source', 'Frequency', 'SMILES', 'SMILES URL', 'SMILES Source', 'Canonical SMILES', 'Split', 'ClusterNo', 'MolCount', 'group'],
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num_rows: 2416
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})
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})
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### Use a dataset to train a model
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One way to use the dataset is through the [MolFlux](https://exscientia.github.io/molflux/) package developed by Exscientia.
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First, from the command line, install `MolFlux` library with `catboost` and `rdkit` support
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