I'm a computer scientist and a doctor in deep learning applied to drug discovery that loves science, music & nerdiness in general!
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reinvent-scaffold-decorator
reinvent-scaffold-decorator PublicA SMILES-based encoder-decoder architecture for molecular scaffold decoration
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reinvent-randomized
reinvent-randomized PublicRecurrent Neural Network using randomized SMILES strings to generate molecules
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reinvent-gdb13
reinvent-gdb13 Public archiveA Recurrent Neural Network implementation that uses SMILES strings to generate molecules from GDB-13
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s3fs-access-grants
s3fs-access-grants PublicTransparent S3 Access Grants for fsspec/s3fs: register once and every read/write routes through a per-grant scoped credential, with no Access Grants logic in application code.
Python
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