Architector for high-throughput cross-periodic table 3D complex building

Rare-earth and actinide complexes are critical for a wealth of clean-energy applications. Three-dimensional (3D) structural generation and prediction for these organometallic systems remains a challenge, limiting opportunities for computational chemical discovery. Here, we introduce Architector, a h...

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Detalles Bibliográficos
Autores principales: Taylor, Michael G., Burrill, Daniel J., Janssen, Jan, Batista, Enrique R., Perez, Danny, Yang, Ping
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Nature Publishing Group UK 2023
Materias:
Article
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10185541/
https://www.ncbi.nlm.nih.gov/pubmed/37188661
http://dx.doi.org/10.1038/s41467-023-38169-2

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10185541/
https://www.ncbi.nlm.nih.gov/pubmed/37188661
http://dx.doi.org/10.1038/s41467-023-38169-2

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