Data-driven discovery of molecular photoswitches with multioutput Gaussian processes
Griffiths, Ryan-Rhys, Greenfield, Jake L, Thawani, Aditya R, Jamasb, Arian R, Moss, Henry B, Bourached, Anthony, Jones, Penelope, McCorkindale, William, Aldrick, Alexander A, Fuchter, Matthew J, Lee, Alpha A
Published in Chemical science (Cambridge) (23.11.2022)
Published in Chemical science (Cambridge) (23.11.2022)
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Achieving Robustness to Aleatoric Uncertainty with Heteroscedastic Bayesian Optimisation
Ryan-Rhys Griffiths, Aldrick, Alexander A, Garcia-Ortegon, Miguel, Lalchand, Vidhi R, Lee, Alpha A
Published in arXiv.org (20.05.2022)
Published in arXiv.org (20.05.2022)
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Journal Article
Data-Driven Discovery of Molecular Photoswitches with Multioutput Gaussian Processes
Ryan-Rhys Griffiths, Greenfield, Jake L, Thawani, Aditya R, Jamasb, Arian R, Moss, Henry B, Bourached, Anthony, Jones, Penelope, McCorkindale, William, Aldrick, Alexander A, Matthew J Fuchter Alpha A Lee
Published in arXiv.org (07.08.2022)
Published in arXiv.org (07.08.2022)
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Journal Article