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Bridging the gap between high-level quantum chemical methods and deep learning models

Author:
Prasad, V. K.; Otero de la Roza, AlbertoUniovi authority; DiLabio, G. A.
Publication date:
2024
Publisher version:
http://dx.doi.org/10.1088/2632-2153/ad27e1
Citación:
Machine Learning: Science and Technology, 5(1), (2024); doi:10.1088/2632-2153/ad27e1
URI:
https://hdl.handle.net/10651/73249
ISSN:
2632-2153
DOI:
10.1088/2632-2153/ad27e1
Patrocinado por:

National Sciences and Engineering Research Council; Canadian Foundation for Innovation; British Columbia Knowledge Development Fund; Spanish Ministerio de Ciencia e Innovacion; Agencia Estatal de Investigacion [PGC2021-125518NB-I00]; EU FEDER funds; Principality of Asturias (FICYT) [AYUD/2021/51036]; EU FEDER; Spanish MCIN/AEI; European Union NextGenerationEU/PRTR; [TED2021-129457B-I00]

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