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Biocatalysed synthesis planning using data-driven learning

Biology

Biocatalysed synthesis planning using data-driven learning

D. Probst, M. Manica, et al.

This paper introduces cutting-edge forward and backward prediction models utilizing the Molecular Transformer, designed specifically to tackle the complexities of predicting enzymatic activity and enzyme selectivity on substrates that have not yet been reported. Conducted by Daniel Probst, Matteo Manica, Yves Gaetan Nana Teukam, Alessandro Castrogiovanni, Federico Paratore, and Teodoro Laino, the research employs the newly compiled ECREACT dataset and provides unprecedented accuracy in enzyme-catalysed reaction predictions.... show more
Citation Metrics
Citations
131
Influential Citations
12
Reference Count
45
Citation by Year

Note: The citation metrics presented here have been sourced from Semantic Scholar and OpenAlex.

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