Search Results for author: Héléna Gaspar

Found 1 papers, 1 papers with code

Molecular representation learning with language models and domain-relevant auxiliary tasks

2 code implementations26 Nov 2020 Benedek Fabian, Thomas Edlich, Héléna Gaspar, Marwin Segler, Joshua Meyers, Marco Fiscato, Mohamed Ahmed

We apply a Transformer architecture, specifically BERT, to learn flexible and high quality molecular representations for drug discovery problems.

Drug Discovery molecular representation +1

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