Reliably assessing the electronic structure of cytochrome P450 on today’s classical computers and tomorrow’s quantum computers

An accurate assessment of how quantum computers can be used for chemical simulation, especially their potential computational advantages, provides important context on how to deploy these future devices. To perform this assessment reliably, quantum resource estimates must be coupled with classical c...

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Detalles Bibliográficos
Autores principales: Goings, Joshua J., White, Alec, Lee, Joonho, Tautermann, Christofer S., Degroote, Matthias, Gidney, Craig, Shiozaki, Toru, Babbush, Ryan, Rubin, Nicholas C.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: National Academy of Sciences 2022
Materias:
Physical Sciences
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9499570/
https://www.ncbi.nlm.nih.gov/pubmed/36095200
http://dx.doi.org/10.1073/pnas.2203533119

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9499570/
https://www.ncbi.nlm.nih.gov/pubmed/36095200
http://dx.doi.org/10.1073/pnas.2203533119

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