Zobrazeno 1 - 3
of 3
pro vyhledávání: '"Alexander A. Aldrick"'
Autor:
Ryan-Rhys Griffiths, Jake L. Greenfield, Aditya R. Thawani, Arian R. Jamasb, Henry B. Moss, Anthony Bourached, Penelope Jones, William McCorkindale, Alexander A. Aldrick, Matthew J. Fuchter, Alpha A. Lee
Publikováno v:
Chemical science. 13(45)
Photoswitchable molecules display two or more isomeric forms that may be accessed using light. Separating the electronic absorption bands of these isomers is key to selectively addressing a specific isomer and achieving high photostationary states wh
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::1a7a8d1acb75725a67810c8f96b93613
https://pubmed.ncbi.nlm.nih.gov/36507171
https://pubmed.ncbi.nlm.nih.gov/36507171
Autor:
Alpha A. Lee, Arian R. Jamasb, Penelope J. Jones, Anthony Bourached, William McCorkindale, Alexander A. Aldrick, Ryan-Rhys Griffiths, Aditya R. Thawani
The space of synthesizable molecules is greater than $10^{60}$, meaning only a vanishingly small fraction of these molecules have ever been realized in the lab. In order to prioritize which regions of this space to explore next, synthetic chemists ne
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::6cbf81a71ef7415800914210fde99299
https://doi.org/10.26434/chemrxiv.12609899
https://doi.org/10.26434/chemrxiv.12609899
Autor:
Alexander A. Aldrick, Vidhi Lalchand, Miguel Garcia-Ortegon, Alpha A. Lee, Ryan-Rhys Griffiths
Publikováno v:
Machine Learning: Science and Technology. 3:015004
Bayesian optimisation is a sample-efficient search methodology that holds great promise for accelerating drug and materials discovery programs. A frequently-overlooked modelling consideration in Bayesian optimisation strategies however, is the repres
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::c458c9a4dfee161a02c7bb3c19375e51
https://doi.org/10.1088/2632-2153/ac298c
https://doi.org/10.1088/2632-2153/ac298c