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Molecule-Specific Uncertainty Quantification in Quantum Chemical Studies

• Authors : Reiher, Markus; id_orcid:0 000-0002-9508-1565

• Source: Israel Journal of Chemistry, 62 (1-2)

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Mechanistic Insights from the Crystal Structure and Computational Analysis of the Radical SAM Deaminase DesII.

• Authors : Hou X; Shaanxi Key Laboratory of Natural Products & Chemical Biology, College of Chemistry & Pharmacy, Northwest A&F University, Yangling, Shaanxi, 712100, China.; Key Laboratory of Quantitative Synthetic Biology, Shenzhen Institute of Synthetic Biology, Shenzhen Institutes of Advanced Technology, Chinese Academy of Sciences, Shenzhen, 518055, China.

Subjects: Catalytic Domain* ; Bacterial Proteins* ; Streptomyces*/Streptomyces*/Streptomyces*/enzymologyStreptomyces venezuelae

• Source: Advanced science (Weinheim, Baden-Wurttemberg, Germany) [Adv Sci (Weinh)] 2024 Sep; Vol. 11 (33), pp. e2403494. Date of Electronic Publication: 2024 Jun 28.Publisher: WILEY-VCH Country of Publication: Germany NLM ID: 101664569 Publication Model: Print-Electronic Cited Medium:

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ClAg 14 (C≡C t Bu) 12 Nanoclusters as Efficient and Selective Electrocatalysts Toward Industrially Relevant CO 2 Conversion.

• Authors : Seong H; Department of Chemistry, Yonsei University, Seoul, 03722, Republic of Korea.; Chang K

• Source: Advanced science (Weinheim, Baden-Wurttemberg, Germany) [Adv Sci (Weinh)] 2024 Mar; Vol. 11 (10), pp. e2306089. Date of Electronic Publication: 2023 Dec 25.Publisher: WILEY-VCH Country of Publication: Germany NLM ID: 101664569 Publication Model: Print-Electronic Cited Medium:

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FP(μ-N) 2 S: A Sulfur-Pnictogen Four-Membered Ring with 6π Electrons.

• Authors : Zhu B; Department of Chemistry, Shanghai Key Laboratory of Molecular Catalysis and Innovative Materials, Fudan University, Shanghai, 200433, China.; Song Y

• Source: Chemistry (Weinheim an der Bergstrasse, Germany) [Chemistry] 2023 Aug 10; Vol. 29 (45), pp. e202300251. Date of ElectronicPublisher: Wiley-VCH Country of Publication: Germany NLM ID: 9513783 Publication Model: Print-Electronic Cited Medium:

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Excited-State Dynamics in All-Polymer Blends with Polymerized Small-Molecule Acceptors.

• Authors : Liu Z; Key Laboratory of Oil and Gas Fine Chemicals, Ministry of Education & Xinjiang Uygur Autonomous Region, School of Chemical Engineering and Technology, Xinjiang University, Urumqi, 830046, China.; National Laboratory of Solid State Microstructures, School of Physics, and Collaborative Innovation Center for Advanced Microstructures, Nanjing University, Nanjing, 210093, China.

• Source: Advanced science (Weinheim, Baden-Wurttemberg, Germany) [Adv Sci (Weinh)] 2023 Aug; Vol. 10 (23), pp. e2301931. Date of Electronic Publication: 2023 Jun 04.Publisher: WILEY-VCH Country of Publication: Germany NLM ID: 101664569 Publication Model: Print-Electronic Cited Medium:

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Tunable Macrocyclic Polyparaphenylene Nanolassos via Copper-Free Click Chemistry.

• Authors : Schaub TA; Department of Chemistry & Biochemistry and Material Science Institute, University of Oregon Eugene, Oregon, 97403, USA.; Zieleniewska A

Subjects: Click Chemistry*/Click Chemistry*/Click Chemistry*/methods ; Azides*/Azides*/Azides*/chemistry; Artificial Intelligence

• Source: Chemistry (Weinheim an der Bergstrasse, Germany) [Chemistry] 2023 Jun 13; Vol. 29 (33), pp. e202300668. Date of ElectronicPublisher: Wiley-VCH Country of Publication: Germany NLM ID: 9513783 Publication Model: Print-Electronic Cited Medium:

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An Air- and Moisture-stable Zinc(II) Carbene Dithiolate Dimer Showing Fast Thermally Activated Delayed Fluorescence and Dexter Energy Transfer Catalysis.

• Authors : Mrózek O; Department of Chemistry and Chemical Biology, TU Dortmund University, Otto-Hahn-Str. 6, 44227, Dortmund, Germany.; Mitra M

• Source: Chemistry (Weinheim an der Bergstrasse, Germany) [Chemistry] 2023 Apr 21; Vol. 29 (23), pp. e202203980. Date of ElectronicPublisher: Wiley-VCH Country of Publication: Germany NLM ID: 9513783 Publication Model: Print-Electronic Cited Medium:

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Mechanistic Insights into the Metal-Free Deoxygenative Borylation of Ketones and Aldehydes with Bis(catecholato)diborane.

• Authors : Zou W; Key Laboratory of Mesoscopic Chemistry of Ministry of Education, Institute of Theoretical and Computational Chemistry, School of Chemistry and Chemical Engineering, Nanjing University, Nanjing, 210023, P. R. China.; Yang M

• Source: Chemistry (Weinheim an der Bergstrasse, Germany) [Chemistry] 2023 Mar 13; Vol. 29 (15), pp. e202203526. Date of ElectronicPublisher: Wiley-VCH Country of Publication: Germany NLM ID: 9513783 Publication Model: Print-Electronic Cited Medium:

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Screening Carbon-Boron Frustrated Lewis Pairs for Small-Molecule Activation including N 2 , O 2 , CO, CO 2 , CS 2 , H 2 O and CH 4 : A Computational Study.

• Authors : Zeng J; State Key Laboratory of Physical Chemistry of Solid Surfaces and Collaborative Innovation Center of Chemistry for Energy Materials (iChEM), Fujian Provincial Key Laboratory of Theoretical and Computational Chemistry and Department of Chemistry, College of Chemistry and Chemical Engineering, Xiamen University, 361005, Xiamen, P. R. China.; Pharmaceutical Research Institute, Wuhan Institute of Technology, No. 206, Guanggu 1st road, 430205, Wuhan, P. R. China.

• Source: Chemistry, an Asian journal [Chem Asian J] 2023 Mar 01; Vol. 18 (5), pp. e202201236. Date of Electronic Publication: 2023 Jan 31.Publisher: Wiley-VCH Country of Publication: Germany NLM ID: 101294643 Publication Model: Print-Electronic Cited Medium:

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Interpretable Machine Learning of Two-Photon Absorption.

• Authors : Su Y; State Key Laboratory of Physical Chemistry of Solid Surfaces, Department of Chemistry, College of Chemistry and Chemical Engineering, iChem, Innovation Laboratory for Sciences and Technologies of Energy Materials of Fujian Province (IKKEM), Xiamen University, 361005, Xiamen, P. R. China.; Dai Y

• Source: Advanced science (Weinheim, Baden-Wurttemberg, Germany) [Adv Sci (Weinh)] 2023 Mar; Vol. 10 (8), pp. e2204902. Date of Electronic Publication: 2023 Jan 19.Publisher: WILEY-VCH Country of Publication: Germany NLM ID: 101664569 Publication Model: Print-Electronic Cited Medium:

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