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Local invertibility and sensitivity of atomic structure-feature mappings
Background: The increasingly common applications of machine-learning schemes to atomic-scale simulations have triggered efforts to better understand the mathematical properties of the mapping between the Cartesian coordinates of the atoms and the variety of representations that can be used to conver...
| Autores principales: | , , , , |
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| Formato: | Online Artículo Texto |
| Lenguaje: | English |
| Publicado: |
F1000 Research Limited
2021
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| Materias: | |
| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10445828/ https://www.ncbi.nlm.nih.gov/pubmed/37645092 http://dx.doi.org/10.12688/openreseurope.14156.1 |