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Predicting Infrared Spectra with Message Passing Neural Networks
Submitted on
Wed, 2021-06-02 11:05
Title
Predicting Infrared Spectra with Message Passing Neural Networks
Publication Type
Journal Article
Year of Publication
2021
Authors
Charles McGill
Michael Forsuelo
Yanfei Guan
William H. Green
Journal
Journal of Chemical Information and Modeling
Volume
61
Pagination
2594–2609
Keywords
DOI
http://dx.doi.org/10.1021/acs.jcim.1c00055
URL
https://doi.org/10.1021/acs.jcim.1c00055
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