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Super High-Throughput Screening of Enzyme Variants by Spectral Graph Convolutional Neural Networks
[Image: see text] Finding new enzyme variants with the desired substrate scope requires screening through a large number of potential variants. In a typical in silico enzyme engineering workflow, it is possible to scan a few thousands of variants, and gather several candidates for further screening...
Autores principales: | , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
American Chemical Society
2023
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Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10373491/ https://www.ncbi.nlm.nih.gov/pubmed/36961994 http://dx.doi.org/10.1021/acs.jctc.2c01227 |