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Parrilla-Gutiérrez, J. M. , Granda, J. M., Ayme, J.-F., Bajczyk, M. D., Wilbraham, L. and Cronin, L. (2024) Electron density-based GPT for optimization and suggestion of host–guest binders. Nature Computational Science, (doi: 10.1038/s43588-024-00602-x) (Early Online Publication)

Asche, S., Pow, R. W., Mehr, H. , Cooper, G. , Sharma, A. and Cronin, L. (2024) Evidence of selection in mineral mediated polymerization reactions executed in a robotic Chemputer system. ChemSystemsChem, e202400006. (doi: 10.1002/syst.202400006) (Early Online Publication)

Leonov, A. I. et al. (2024) An integrated self-optimizing programmable chemical synthesis and reaction engine. Nature Communications, 15, 1240. (doi: 10.1038/s41467-024-45444-3) (PMID:38336880) (PMCID:PMC10858227)

Bell, N. L. , Boser, F., Bubliauskas, A., Willcox, D. R., Sandoval Luna, V. E. and Cronin, L. (2024) Autonomous execution of highly reactive chemical transformations in the Schlenkputer. Nature Chemical Engineering, 1, pp. 180-189. (doi: 10.1038/s44286-023-00024-y)

Matysiak, B. M., Thomas, D. and Cronin, L. (2023) Reaction kinetics using a Chemputable framework for data collection and analysis. Angewandte Chemie (International Edition), (doi: 10.1002/anie.202315207) (PMID:38155102) (Early Online Publication)

Sharma, A. , Czégel, D., Lachmann, M., Kempes, C. P., Walker, S. I. and Cronin, L. (2023) Assembly theory explains and quantifies selection and evolution. Nature, 622(7982), pp. 321-328. (doi: 10.1038/s41586-023-06600-9) (PMID:37794189) (PMCID:PMC10567559)

Wang, H., Manzano, J. S., Kitson, P. J., Mullin, M., Lin, C.-G., Slowing, I. I. and Cronin, L. (2023) Digitizing protocols into single reactors for the one-pot synthesis of nanomaterials. Matter, 6(7), pp. 2383-2394. (doi: 10.1016/j.matt.2023.05.029)

Jiang, Y., Sharma, A. and Cronin, L. (2023) An accelerated method for investigating spectral properties of dynamically evolving nanostructures. Journal of Physical Chemistry Letters, 14(16), pp. 3929-3938. (doi: 10.1021/acs.jpclett.3c00395) (PMID:37078273) (PMCID:PMC10150391)

M. Mehr, S. H. , Caramelli, D. and Cronin, L. (2023) Digitizing chemical discovery with a Bayesian explorer for interpreting reactivity data. Proceedings of the National Academy of Sciences of the United States of America, 120(17), e2220045120. (doi: 10.1073/pnas.2220045120) (PMID:37068251)

Manzano, J. S., Hou, W., Zalesskiy, S. S., Frei, P., Wang, H., Kitson, P. J. and Cronin, L. (2022) An autonomous portable platform for universal chemical synthesis. Nature Chemistry, 14(11), pp. 1311-1318. (doi: 10.1038/s41557-022-01016-w) (PMID:36202987)

Jiang, Y., Salley, D., Sharma, A. , Keenan, G., Mullen, M. and Cronin, L. (2022) An artificial intelligence enabled chemical synthesis robot for exploration and optimization of nanomaterials. Science Advances, 8(40), eabo2626. (doi: 10.1126/sciadv.abo2626) (PMID:36206340) (PMCID:PMC9544322)

Rohrbach, S. et al. (2022) Digitization and validation of a chemical synthesis literature database in the ChemPU. Science, 377(6602), pp. 172-180. (doi: 10.1126/science.abo0058)

Marshall, S. M., Moore, D. G., Murray, A. R.G., Walker, S. I. and Cronin, L. (2022) Formalising the pathways to life using assembly spaces. Entropy, 24(7), 884. (doi: 10.3390/e24070884) (PMID:35885107) (PMCID:PMC9323097)

Bubliauskas, A., Blair, D. J., Powell-Davies, H., Kitson, P. J., Burke, M. and Cronin, L. (2022) A practical approach to combine modular reactions and reactionware for the digitization of chemical synthesis. Angewandte Chemie (International Edition), 61(24), e202116108. (doi: 10.1002/anie.202116108) (PMID:35257447)

Passadis, S. S., Hadjithoma, S., Papanikolaou, M. G., Keramidas, A. D., Miras, H. N. and Kabanos, T. A. (2022) Acid/base responsive assembly/dis-assembly of a family of zirconium(iv) clusters with a cyclic imide-dioxime ligand. Dalton Transactions, 51(5), pp. 1806-1818. (doi: 10.1039/d1dt03641f) (PMID:35018917)

Hammer, A. J.S., Leonov, A. I., Bell, N. L. and Cronin, L. (2021) Chemputation and the standardization of chemical informatics. JACS Au, 1(10), pp. 1572-1587. (doi: 10.1021/jacsau.1c00303) (PMCID:PMC8549037)

Liu, Y. , Mathis, C., Marshall, S., Bajczyk, M. D., Wilbraham, L. and Cronin, L. (2021) Exploring and mapping chemical space with molecular assembly trees. Science Advances, 7(39), eabj2465. (doi: 10.1126/sciadv.abj2465) (PMID:34559562)

Asche, S., Cooper, G. J.T. , Keenan, G., Mathis, C. and Cronin, L. (2021) A robotic prebiotic chemist probes long term reactions of complexifying mixtures. Nature Communications, 12, 3547. (doi: 10.1038/s41467-021-23828-z) (PMID:34112788) (PMCID:PMC8192940)

Marshall, S. M. et al. (2021) Identifying molecules as biosignatures with assembly theory and mass spectrometry. Nature Communications, 12, 3033. (doi: 10.1038/s41467-021-23258-x) (PMID:34031398) (PMCID:PMC8144626)

Hou, W., Bubliauskas, A., Kitson, P. J., Francoia, J.-P., Powell-Davies, H., Parrilla Gutierrez, J. M. , Frei, P., Manzano, J. S. and Cronin, L. (2021) Automatic generation of 3D-printed reactionware for chemical synthesis digitization using ChemSCAD. ACS Central Science, 7(2), pp. 212-218. (doi: 10.1021/acscentsci.0c01354) (PMCID:PMC7908023)

Wilbraham, L. , Mehr, S. H. M. and Cronin, L. (2021) Digitizing chemistry using the chemical processing unit: from synthesis to discovery. Accounts of Chemical Research, 54(2), pp. 253-262. (doi: 10.1021/acs.accounts.0c00674) (PMID:33370095)

Porwol, L., Kowalski, D. J., Henson, A. , Long, D.-L. , Bell, N. L. and Cronin, L. (2020) An autonomous chemical robot discovers the rules of supramolecular chemistry without prior knowledge. Angewandte Chemie (International Edition), 59(28), pp. 11256-11261. (doi: 10.1002/anie.202000329) (PMID:32419277) (PMCID:PMC7384156)

Zhan, C.-H., Zheng, Q., Long, D.-L. , Vilà‐Nadal, L. and Cronin, L. (2019) Controlling the reactivity of the [P8W48O184]40– inorganic ring and its assembly into POMZite inorganic frameworks with silver ions. Angewandte Chemie (International Edition), 131(48), pp. 17442-6. (doi: 10.1002/anie.201911170) (PMID:31538679) (PMCID:PMC6900112)

McGlynn, J. C. et al. (2019) The rapid electrochemical activation of MoTe2 for the hydrogen evolution reaction. Nature Communications, 10, 4916. (doi: 10.1038/s41467-019-12831-0) (PMID:31664018) (PMCID:PMC6820771)

Janusson, E. , de Kler, N., Vilà-Nadal, L. , Long, D.-L. and Cronin, L. (2019) Synthesis of polyoxometalate clusters using carbohydrates as reducing agents leads to isomer-selection. Chemical Communications, 55(41), pp. 5797-5800. (doi: 10.1039/C9CC02361E) (PMID:31041957)

Martín, S., Takashima, Y., Lin, C.-G., Song, Y.-F., Miras, H. N. and Cronin, L. (2019) Integrated synthesis of gold nanoparticles coated with polyoxometalate clusters. Inorganic Chemistry, 58(7), pp. 4110-4116. (doi: 10.1021/acs.inorgchem.8b03013) (PMID:30869513)

McAllister, J., Bandeira, N. A.G., McGlynn, J. C., Ganin, A. Y. , Song, Y.-F., Bo, C. and Miras, H. N. (2019) Tuning and mechanistic insights of metal chalcogenide molecular catalysts for the hydrogen-evolution reaction. Nature Communications, 10, 370. (doi: 10.1038/s41467-018-08208-4) (PMID:30670694) (PMCID:PMC6342911)

Turk-MacLeod, R., Henson, A. , Rodriguez-Garcia, M., Gibson, G. M. , Aragon Camarasa, G. , Caramelli, D., Padgett, M. J. and Cronin, L. (2018) Approach to classify, separate, and enrich objects in groups using ensemble sorting. Proceedings of the National Academy of Sciences of the United States of America, 115(22), pp. 5681-5685. (doi: 10.1073/pnas.1721929115) (PMID:29760051) (PMCID:PMC5984510)

This list was generated on Wed Mar 27 13:32:58 2024 GMT.