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Systematic, computational discovery of multicomponent and one-pot reactions.
Roszak R, Gadina L, Wołos A, Makkawi A, Mikulak-Klucznik B, Bilgi Y, Molga K, Gołębiowska P, Popik O, Klucznik T, Szymkuć S, Moskal M, Baś S, Frydrych R, Mlynarski J, Vakuliuk O, Gryko DT, Grzybowski BA. Roszak R, et al. Among authors: grzybowski ba. Nat Commun. 2024 Nov 27;15(1):10285. doi: 10.1038/s41467-024-54611-5. Nat Commun. 2024. PMID: 39604395 Free PMC article.
Delocalized, asynchronous, closed-loop discovery of organic laser emitters.
Strieth-Kalthoff F, Hao H, Rathore V, Derasp J, Gaudin T, Angello NH, Seifrid M, Trushina E, Guy M, Liu J, Tang X, Mamada M, Wang W, Tsagaantsooj T, Lavigne C, Pollice R, Wu TC, Hotta K, Bodo L, Li S, Haddadnia M, Wołos A, Roszak R, Ser CT, Bozal-Ginesta C, Hickman RJ, Vestfrid J, Aguilar-Granda A, Klimareva EL, Sigerson RC, Hou W, Gahler D, Lach S, Warzybok A, Borodin O, Rohrbach S, Sanchez-Lengeling B, Adachi C, Grzybowski BA, Cronin L, Hein JE, Burke MD, Aspuru-Guzik A. Strieth-Kalthoff F, et al. Among authors: grzybowski ba. Science. 2024 May 17;384(6697):eadk9227. doi: 10.1126/science.adk9227. Epub 2024 May 17. Science. 2024. PMID: 38753786
Accelerated chemical science with AI.
Back S, Aspuru-Guzik A, Ceriotti M, Gryn'ova G, Grzybowski B, Gu GH, Hein J, Hippalgaonkar K, Hormázabal R, Jung Y, Kim S, Kim WY, Moosavi SM, Noh J, Park C, Schrier J, Schwaller P, Tsuda K, Vegge T, von Lilienfeld OA, Walsh A. Back S, et al. Among authors: grzybowski b. Digit Discov. 2023 Dec 6;3(1):23-33. doi: 10.1039/d3dd00213f. eCollection 2024 Jan 17. Digit Discov. 2023. PMID: 38239898 Free PMC article. Review.
AlphaFold2 Can Predict Single-Mutation Effects.
McBride JM, Polev K, Abdirasulov A, Reinharz V, Grzybowski BA, Tlusty T. McBride JM, et al. Among authors: grzybowski ba. Phys Rev Lett. 2023 Nov 24;131(21):218401. doi: 10.1103/PhysRevLett.131.218401. Phys Rev Lett. 2023. PMID: 38072605
232 results