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Identifying domains of applicability of machine learning models for materials science

Although machine learning (ML) models promise to substantially accelerate the discovery of novel materials, their performance is often still insufficient to draw reliable conclusions. Improved ML models are therefore actively researched, but their design is currently guided mainly by monitoring the...

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Detalles Bibliográficos
Autores principales: Sutton, Christopher, Boley, Mario, Ghiringhelli, Luca M., Rupp, Matthias, Vreeken, Jilles, Scheffler, Matthias
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Nature Publishing Group UK 2020
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC7474068/
https://www.ncbi.nlm.nih.gov/pubmed/32887879
http://dx.doi.org/10.1038/s41467-020-17112-9