Search Results for author: Yves Gaetan Nana Teukam

Found 2 papers, 1 papers with code

Accelerating Material Design with the Generative Toolkit for Scientific Discovery

1 code implementation • 8 Jul 2022 • Matteo Manica, Jannis Born, Joris Cadow, Dimitrios Christofidellis, Ashish Dave, Dean Clarke, Yves Gaetan Nana Teukam, Giorgio Giannone, Samuel C. Hoffman, Matthew Buchan, Vijil Chenthamarakshan, Timothy Donovan, Hsiang Han Hsu, Federico Zipoli, Oliver Schilter, Akihiro Kishimoto, Lisa Hamada, Inkit Padhi, Karl Wehden, Lauren McHugh, Alexy Khrabrov, Payel Das, Seiji Takeda, John R. Smith

With the growing availability of data within various scientific domains, generative models hold enormous potential to accelerate scientific discovery.

Drug Discovery Materials Screening +1

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Identification of Enzymatic Active Sites with Unsupervised Language Modeling

no code implementations • NeurIPS Workshop AI4Scien 2021 • Loïc Kwate Dassi, Matteo Manica, Daniel Probst, Philippe Schwaller, Yves Gaetan Nana Teukam, Teodoro Laino

Herein, we apply a Transformer architecture to a language representation of bio-catalyzed chemical reactions to learn the signal at the base of the substrate-active site atomic interactions.

Language Modeling Language Modelling

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