Artificial intelligence driven design of catalysts and materials for ring opening polymerization using a domain-specific language
Abstract Advances in machine learning (ML) and automated experimentation are poised to vastly accelerate research in polymer science. Data representation is a critical aspect for enabling ML integration in research workflows, yet many data models impose significant rigidity making it difficult to ac...
Main Authors: | Nathaniel H. Park, Matteo Manica, Jannis Born, James L. Hedrick, Tim Erdmann, Dmitry Yu. Zubarev, Nil Adell-Mill, Pedro L. Arrechea |
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Format: | Article |
Language: | English |
Published: |
Nature Portfolio
2023-06-01
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Series: | Nature Communications |
Online Access: | https://doi.org/10.1038/s41467-023-39396-3 |
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