Chem. Sci., 2023, 14,10979-10980
DOI: 10.1039/D3SC90184J, Correction

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M. Roger, L. Artiglia, A. Boucly, F. Buttignol, M. Agote-Arán, J. A. van Bokhoven, O. Kröcher, D. Ferri
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Chem. Sci., 2023, Advance Article
DOI: 10.1039/D3SC01594G, Edge Article

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Jinling Li, Mahima Sharma, Richard Meek, Amani Alhifthi, Zachary Armstrong, Niccolay Madiedo Soler, Mihwa Lee, Ethan D. Goddard-Borger, James N. Blaza, Gideon J. Davies, Spencer J. Williams
Sulfolactate is an important species in the biogeochemical sulfur cycle. Herein we report the 3D cryo-EM structure and kinetics of its biosynthetic enzyme, sulfolactaldehyde dehydrogenase.
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Chem. Sci., 2023, Advance Article
DOI: 10.1039/D3SC02995F, Edge Article

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Jianmin Jiao, Heng Li, Wang Xie, Yue Zhao, Chen Lin, Juli Jiang, Leyong Wang
CTX[P(O)Ph], a censer-shaped macrocycle, was used as a host to crystallize with oily guest organic molecules. Their well-ordered crystal structures and absolute configurations were described unambiguously by single-crystal X-ray diffraction.
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Chem. Sci., 2023, 14,10628-10630
DOI: 10.1039/D3SC90185H, Commentary

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Mingyu Li, Jian Zhang
Big data-driven AI modeling has greatly revolutionized drug discovery. Chen et al. have paved a way for drug discovery from traditional Chinese medicine (TCM) sources by developing TCMBank, a centralized resource which standardizes TCM-related big data and integrates an AI drug discovery pipeline.
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Chem. Sci., 2023, Advance Article
DOI: 10.1039/D3SC03465H, Edge Article

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Qianfeng Qiu, Qingkai Qi, Junichi Usuba, Karina Lee, Ivan Aprahamian, Grace G. D. Han
Visible-light-absorbing photoswitches based on the Azo-BF₂ scaffold show reversible isomerization in the solid state, storing photon energy and releasing thermal energy on demand.
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Chem. Sci., 2023, 14,10847-10860
DOI: 10.1039/D3SC03641C, Edge Article

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Kurtis M. Carsch, Sasha C. North, Ida M. DiMucci, Andrei Iliescu, Petra Vojáčková, Thomas Khazanov, Shao-Liang Zheng, Thomas R. Cundari, Kyle M. Lancaster, Theodore A. Betley
A dipyrrin-supported copper complex mediates C–H bond amination and aziridination of exogenous substrates using electron-deficient arylazides, proceeding through copper-nitrene adducts.
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Chem. Sci., 2023, 14,10777-10785
DOI: 10.1039/D3SC03706A, Edge Article

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Wei Fang, Eric R. Heller, Jeremy O. Richardson
The geometric-phase effect appears in reactions which tunnel around conical intersections. Our novel instanton theories indicate that this plays an important role in certain charge-transfer reactions, even at room temperature.
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Chem. Sci., 2023, Advance Article
DOI: 10.1039/D3SC00688C, Edge Article

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Lida Tan, Xianghua Kong, Mingxin Liu, Hui Su, Hong Guo, Chao-Jun Li
The direct functionalization of inert C–H bonds has long been a “holy grail” for the chemistry world.
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Chem. Sci., 2023, Advance Article
DOI: 10.1039/D3SC02802J, Edge Article

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Inês C. B. Martins, Anders S. Larsen, Anders Ø. Madsen, Olivia Aalling Frederiksen, Alexandra Correia, Kirsten M. Ø. Jensen, Henrik S. Jeppesen, Thomas Rades
Three polyamorphs of hydrochlorothiazide with distinct physicochemical properties were discovered. MD simulations show different dihedral angle distributions in polyamorphs I and II. Polyamorphs I and III were converted into polyamorph II.
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Chem. Sci., 2023, 14,10806-10811
DOI: 10.1039/D3SC04073A, Edge Article

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David Just, Carlos R. Gonçalves, Uroš Vezonik, Daniel Kaiser, Nuno Maulide
A transformation that delivers amino-butyrolactones from unactivated alkenes, characterized by its simplicity, ready availability of reagents and broad functional group tolerance, is reported.
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