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Currently displaying 1801 - 1820 of 29785 publications

Ortho -Selective amination of arene carboxylic acids via rearrangement of acyl O -hydroxylamines

JE Gillespie, NYS Lam, RJ Phipps – Chemical science (2023) 14, 10103

(DOI: 10.1039/d3sc03293k)

pHbot: Self-Driven Robot for pH Adjustment of Viscous Formulations via Physics-informed-ML

A Chitre, J Cheng, S Ahmed, R Querimit, K Hippalgaonkar, A Lapkin – (2023)

(DOI: 10.26434/chemrxiv-2023-c46mv)

Machine learning force fields for molecular liquids: Ethylene Carbonate/Ethyl Methyl Carbonate binary solvent

I-B Magdău, DJ Arismendi-Arrieta, HE Smith, CP Grey, K Hermansson, G Csányi – npj Computational Materials (2023) 9, 146

(DOI: 10.1038/s41524-023-01100-w)

Machine learning force fields for molecular liquids: Ethylene Carbonate/Ethyl Methyl Carbonate binary solvent

I-B Magdău, DJ Arismendi-Arrieta, HE Smith, CP Grey, K Hermansson, G Csányi – Npj Computational Materials (2023) 9, 146

(DOI: 10.1038/s41524-023-01100-w)

Three-dimensional operando optical imaging of particle and electrolyte heterogeneities inside Li-ion batteries.

R Pandya, L Valzania, F Dorchies, F Xia, J Mc Hugh, A Mathieson, HJ Tan, TG Parton, L Godeffroy, K Mazloomian, TS Miller, F Kanoufi, M De Volder, J-M Tarascon, S Gigan, HB de Aguiar, A Grimaud – Nat Nanotechnol (2023) 18, 1185

(DOI: 10.1038/s41565-023-01466-4)

Open-chain thiamine analogues as potent inhibitors of thiamine pyrophosphate (TPP)-dependent enzymes

AHY Chan, TCS Ho, FJ Leeper – Org Biomol Chem (2023) 21, 6531

(DOI: 10.1039/d3ob00884c)

Proximity-Enabled Photochemical C-H Functionalization using a Covalent Organic Framework-Confined Fe<sub>2</sub><sup>IV</sup>-μ-oxo Species in Water.

P Majumder, A Basak, H Kuiry, HS Sasmal, S Karak, P Saha, B Chandra, S Sen Gupta, R Banerjee – J Am Chem Soc (2023) 145, 18855

(DOI: 10.1021/jacs.3c04409)

Reversible spin-optical interface in luminescent organic radicals

S Gorgon, K Lv, J Grüne, BH Drummond, WK Myers, G Londi, G Ricci, D Valverde, C Tonnelé, P Murto, AS Romanov, D Casanova, V Dyakonov, A Sperlich, D Beljonne, Y Olivier, F Li, RH Friend, EW Evans – Nature (2023) 620, 538

(DOI: 10.1038/s41586-023-06222-1)

Quantitative real-time in-cell imaging reveals heterogeneous clusters of proteins prior to condensation.

C Lan, J Kim, S Ulferts, F Aprile-Garcia, S Weyrauch, A Anandamurugan, R Grosse, R Sawarkar, A Reinhardt, T Hugel – Nature Communications (2023) 14, 4831

(DOI: 10.1038/s41467-023-40540-2)

Secondary Processes Dominate the Quiescent, Spontaneous Aggregation of α-Synuclein at Physiological pH with Sodium Salts.

RI Horne, MA Metrick, W Man, DJ Rinauro, ZF Brotzakis, S Chia, G Meisl, M Vendruscolo – ACS chemical neuroscience (2023) 14, 3125

(DOI: 10.1021/acschemneuro.3c00282)

Glutamate helps unmask the differences in driving forces for phase separation versus clustering of FET family proteins in sub-saturated solutions

M Kar, LT Vogel, G Chauhan, H Ausserwöger, TJ Welsh, AR Kamath, TPJ Knowles, AA Hyman, CAM Seidel, RV Pappu – (2023)

(DOI: 10.1101/2023.08.11.552963)

Multiplexed Digital Characterisation of Misfolded Protein Oligomers via Solid-State Nanopores

SE Sandler, RI Horne, S Rocchetti, R Novak, N-S Hsu, MC Cruz, ZF Brotzakis, RC Gregory, S Chia, GJL Bernardes, UF Keyser, M Vendruscolo – (2023)

(DOI: 10.1101/2023.08.09.552642)

Best practices for experiments and reporting in photocatalytic CO2 reduction

M Bonchio, J Bonin, O Ishitani, T-B Lu, T Morikawa, AJ Morris, E Reisner, D Sarkar, FM Toma, M Robert – Nature Catalysis (2023) 6, 657

(DOI: 10.1038/s41929-023-00992-7)

Disulfide re-bridging reagents for single-payload antibody-drug conjugates.

TA King, SJ Walsh, M Kapun, T Wharton, S Krajcovicova, MS Glossop, DR Spring – Chemical Communications (2023) 59, 9868

(DOI: 10.1039/d3cc02980h)

Photocatalytic CO2 reduction

S Fang, M Rahaman, J Bharti, E Reisner, M Robert, GA Ozin, YH Hu – Nature Reviews Methods Primers (2023) 3, 61

(DOI: 10.1038/s43586-023-00243-w)

14 examples of how LLMs can transform materials science and chemistry: a reflection on a large language model hackathon.

KM Jablonka, Q Ai, A Al-Feghali, S Badhwar, JD Bocarsly, AM Bran, S Bringuier, LC Brinson, K Choudhary, D Circi, S Cox, WA de Jong, ML Evans, N Gastellu, J Genzling, MV Gil, AK Gupta, Z Hong, A Imran, S Kruschwitz, A Labarre, J Lála, T Liu, S Ma, S Majumdar, GW Merz, N Moitessier, E Moubarak, B Mouriño, B Pelkie, M Pieler, MC Ramos, B Ranković, SG Rodriques, JN Sanders, P Schwaller, M Schwarting, J Shi, B Smit, BE Smith, J Van Herck, C Völker, L Ward, S Warren, B Weiser, S Zhang, X Zhang, GA Zia, A Scourtas, KJ Schmidt, I Foster, AD White, B Blaiszik – Digit Discov (2023) 2, 1233

(DOI: 10.1039/d3dd00113j)