Judah Immanuel
commited on
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c042042
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47c6a19
Update README.md
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README.md
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results: []
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widget:
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- text: O=C([C@@H](c1ccc(cc1)O)N)<mask>[C@@H]1C(=O)N2[C@@H]1SC([C@@H]2C(=O)O)(C)C
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pipeline_tag: fill-mask
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---
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A BERT model trained on a list of 50,000 SMILES for MLM
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```
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O=C([C@@H](c1ccc(cc1)O)N)N[C@@H]1C(=O)N2[C@@H]1SC([C@@H]2C(=O)O)(C)C
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```
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## Model description
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This model is a BERT model that was trained on a list of 50k SMILES. The SMILES were sourced from BindingDB and the compounds bind to certain proteins
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results: []
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widget:
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- text: O=C([C@@H](c1ccc(cc1)O)N)<mask>[C@@H]1C(=O)N2[C@@H]1SC([C@@H]2C(=O)O)(C)C
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- text: Oc1ccc2CC(N3C)C4C=CC(O)C5Oc1c2C45CC3
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pipeline_tag: fill-mask
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---
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A BERT model trained on a list of 50,000 SMILES for MLM
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Examples:
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Amoxicillin
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```
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O=C([C@@H](c1ccc(cc1)O)N)N[C@@H]1C(=O)N2[C@@H]1SC([C@@H]2C(=O)O)(C)C
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```
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Morphine
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```
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Oc1ccc2CC(N3C)C4C=CC(O)C5Oc1c2C45CC3
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```
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## Model description
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This model is a BERT model that was trained on a list of 50k SMILES. The SMILES were sourced from BindingDB and the compounds bind to certain proteins
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