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Francesca Peccati, Elizabeth L. Noey, K.N. Houk, Sílvia Osuna, Gonzalo Jiménez-Osés
Interplay Between Substrate Polarity and Protein Dynamics in Evolved Kemp Eliminases
ChemCatChem, 2024, [], e202400444
DOI: 10.1002/cctc.202400444
OpenAccess: Link
Keywords: Enzyme design

Luis Leyva-Parra, Ricardo Pino-Rios, Diego Inostroza, Miquel Solà, Mercedes Alonso, William Tiznado
Aromaticity and Magnetic Behavior in Benzenoids: Unraveling Ring Current Combinations
Chemistry A European J, 2024, 30, e202302415
DOI: 10.1002/chem.202302415
OpenAccess: –
Keywords: Aromaticity, Chemical bonding, Method development

Emily Monkcom, Laura Gomez Martin, Martin Lutz, Shengfa Ye, Eckhard Bill, Miquel Costas, RobertusJohannes Klein Gebbink
Synthesis, Structure and Reactivity of a Mononuclear N,N,O‐Bound Fe(II) α‐Keto‐Acid Complex
Chemistry A European J, 2024, 30, e202302710
DOI: 10.1002/chem.202302710
OpenAccess: Link
Keywords: High-valent metal complexes, Ligand design, Reaction mechanisms

Michał Michalak, Paweł Czerwiński, Katarzyna Śniady-Maciążek, Szymon Musioł, Oksana Danylyuk, Michał Wierzbicki, Michele Tomasini, Albert Poater
Chiral NHC Ligands for Enantioselective Gold(I) Catalysis Under Aerobic Conditions: the Importance of Conformational Flexibility and Steric Hindrance of NHC Ligand on Reactivity
Chemistry A European J, 2024, 30, e202303241
DOI: 10.1002/chem.202303241
OpenAccess: –
Keywords: Chemical bonding, Computational chemistry, Joint Exp-Comp, Organometallics, Reaction mechanisms

O. A. Stasyuk, A. A. Voityuk, A. J. Stasyuk
Facilitating Electron Transfer by Resizing Cyclocarbon Acceptor from C₁₈ to C₁₆
Chemistry A European J, 2024, 30, e202400215
DOI: 10.1002/chem.202400215
OpenAccess: Link
Keywords: Aromaticity, Computational chemistry

Chongwei Zhu, Alix Saquet, Valérie Maraval, Christian Bijani, Xiuling Cui, Albert Poater, Remi Chauvin
From Stilbenes tocarbo ‐Stilbenes: an Encouraging Prospect
Chemistry A European J, 2024, 30, e202400451
DOI: 10.1002/chem.202400451
OpenAccess: Link
Keywords: Aromaticity, Chemical bonding, Computational chemistry, Cycloaddition, Excited states

Albert Artigas, Yannick Carissan, Denis Hagebaum-Reignier, Harald Bock, Fabien Durola, Yoann Coquerel
Aromaticity in Semi‐Condensed Figure‐Eight Molecules
Chemistry A European J, 2024, 30, e202401016
DOI: 10.1002/chem.202401016
OpenAccess: Link
Keywords: Aromaticity

A. J. Stasyuk, Jordi Poater, Henrik Ottosson
A Voyage into Chemical Bonds and Aromaticity
Chemistry A European J, 2024, 30, e202401206
DOI: 10.1002/chem.202401206
OpenAccess: Link
Keywords: Aromaticity, Computational chemistry

Joan Grèbol-Tomàs, Eduard Matito, Pedro Salvador
Can Aromaticity be Evaluated Using Atomic Partitions based on the Hilbert‐space?
Chemistry A European J, 2024, 30, e202401282
DOI: 10.1002/chem.202401282
OpenAccess: Link
Keywords: Aromaticity, Computational chemistry, Method development

Gibu George, Sergio Posada-Pérez
Interaction of C₆₀ with Methylammonium Lead Iodide Perovskite Surfaces: Unveiling the Role of C₆₀ in Surface Engineering
Chemistry A European J, 2024, 30, e202401283
DOI: 10.1002/chem.202401283
OpenAccess: Link
Keywords: Aromaticity, Computational chemistry