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Uncertainty quantification in classical molecular dynamics

Molecular dynamics simulation is now a widespread approach for understanding complex systems on the atomistic scale. It finds applications from physics and chemistry to engineering, life and medical science. In the last decade, the approach has begun to advance from being a computer-based means of r...

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Bibliografski detalji
Izdano u:Philos Trans A Math Phys Eng Sci
Glavni autori: Wan, Shunzhou, Sinclair, Robert C., Coveney, Peter V.
Format: Artigo
Jezik:Inglês
Izdano: The Royal Society Publishing 2021
Teme:
Online pristup:https://ncbi.nlm.nih.gov/pmc/articles/PMC8059622/
https://ncbi.nlm.nih.gov/pubmed/33775140
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1098/rsta.2020.0082
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