A general model to predict small molecule substrates of enzymes based on machine and deep learning
Abstract For most proteins annotated as enzymes, it is unknown which primary and/or secondary reactions they catalyze. Experimental characterizations of potential substrates are time-consuming and costly. Machine learning predictions could provide an efficient alternative, but are hampered by a lack...
Main Authors: | Alexander Kroll, Sahasra Ranjan, Martin K. M. Engqvist, Martin J. Lercher |
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Format: | Article |
Language: | English |
Published: |
Nature Portfolio
2023-05-01
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Series: | Nature Communications |
Online Access: | https://doi.org/10.1038/s41467-023-38347-2 |
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