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2026

Light-Induced Rotation of a Molecular Motor in the Confined Space of a Metal–Organic Nanocage

Authors: Carles Fuertes-Espinosa, Marco Ovalle, Yohan Gisbert, Clara Sabrià, Valentina Iannace, Josep M. Luis, Ferran Feixas, Alexander Ryabchun, Xavi Ribas, Ben L. Feringa

Journal of the American Chemical Society, 2026, 148, 4, 4189-4197

DOI: 10.1021/jacs.5c16349

Engineering non-haem enzymes for nickel-catalysed C(sp2)‒S coupling via ligand-to-metal charge transfer photocatalysis

Authors: Xiuze Wang, Xianhai Tian, Xiahe Chen, Guoxiong Xu, Jared C. Paris, Yuqi Song, Yuxuan Su, James G. Zhang, Xin Hong, Marc Garcia-Borràs, Arthur E. Bragg, Yisong Guo, Yunfang Yang, Xiongyi Huang

Nature Synthesis, 2026

DOI: 10.1038/s44160-026-01003-w

Inactive but Essential: The Role of the Inactive State of E49 in the Mechanism of the Alpha Subunit of Tryptophan Synthase and Its Stand-Alone Blueprint Zm BX1

Authors: Cristina Duran, Sílvia Osuna

ACS Catalysis, 2026, 16, 4, 3628-3636

DOI: 10.1021/acscatal.5c08026

Selective CO 2 Electroreduction to CO by an Organometallic Nickel Catalyst Featuring a C 3 –Symmetric Tris(Phosphino)Alkyl Ligand

Authors: Sergio Fernández, Klaudia Michaliszyn, Ekaterina S. Smirnova, Marc Robert, Josep M. Luis, Julio Lloret-Fillol

ACS Catalysis, 2026, 16, 4, 3831-3840

DOI: 10.1021/acscatal.5c08299

Improving the SSIR Method: Implementation of an Exhaustive Multilevel Scan for Categorical Variables

Authors: Emili Besalú

International Journal of Molecular Sciences, 2026, 27, 4, 1972

DOI: 10.3390/ijms27041972

Engineering Cumene Dioxygenase for Regioselective Hydroxylation of Monoterpenes and Monoterpenoids

Authors: Jona T. Schelle, Julian L. Wissner, Isabell Muth, Carla Calvó‐Tusell, Jonathan Berger, Marc Garcia‐Borràs, Gloria Saab‐Rincón, Bernhard Hauer

Advanced Synthesis & Catalysis, 2026, 368, 4

DOI: 10.1002/adsc.70323

Desymmetrization of Malonic Monoesters and Malonic Acids via Enantioselective Catalytic C(sp 3 )─H Oxidation

Authors: Nikos Siakavaras, Arnau Call, Massimo Bietti, Miquel Costas

Angewandte Chemie International Edition, 2026

DOI: 10.1002/anie.1030779

Iron(III) complexes of tridentate (NNO) ligands: Efficient catalysts for the synthesis of aminophenoxazinones in aqueous medium

Authors: Thasnim P Mohammed, Kishor Ghimirey Sharma, Madhuri Priya Sivaramakrishnan, Sethuraman Muthuramalingam, Prabha Vadivelu, Marappan Velusamy, Muniyandi Sankaralingam

Journal of Inorganic Biochemistry, 2026, 275, 113120

DOI: 10.1016/j.jinorgbio.2025.113120

Catalytic nanocellulose membranes for environmental remediation

Authors: Tushar Kanti Das, Marcin Jesionek, Muhammad Danish Ali, Mirosława Kępińska, Maciej Zubko, Marcin Godzierz, Paweł Chaber, Albert Poater

Environmental Nanotechnology, Monitoring & Management, 2026, 26, 101175

DOI: 10.1016/j.enmm.2026.101175

Quaternary ammonium salt ionic liquids as catalysts in the cycloaddition reaction of epoxides with CO2 in the presence of hydrogen bond donors

Authors: Thalia Ortiz-Garcia, Mahrou Moshfeghnia, Rabab Maqsood, Montserrat Rodríguez-Pizarro, Quim Tarrés, Anna Pla-Quintana, Valerio D'Elia, Sergio Posada-Pérez, Albert Poater

Journal of Molecular Liquids, 2026, 459, 129824

DOI: 10.1016/j.molliq.2026.129824

Energetic Preferences in Cyclic π-Conjugated Systems: Aromaticity Localizes and Antiaromaticity Spreads

Authors: Miquel Solà, Luigi Cavallo

Chemistry, 2026, 8, 1, 7

DOI: 10.3390/chemistry8010007

Rh-Catalyzed Cycloaddition Cascade of Allenynes and Maleimides: A Powerful Strategy for Constructing Complex Pentacyclic Structures with a Bicyclo[2.2.2]octene Core

Authors: Elias A. Romero-Cavagnaro, Albert Artigas, Anna Pla-Quintana, Anna Roglans

Organic Letters, 2026, 28, 1, 141-146

DOI: 10.1021/acs.orglett.5c04524

Characterization of a Silver Vinylcarbene Intermediate in Carbene–Alkyne Metathesis and Its Concerted C(sp 2 )–H Bond Insertion

Authors: Àlex Díaz-Jiménez, Roger Monreal-Corona, Arijit Saha, Andrea Álvarez-Núñez, Anna Company, Teodor Parella, Pedro J. Pérez, Ana Caballero, Anna Roglans, Albert Poater, Anna Pla-Quintana

Journal of the American Chemical Society, 2026, 148, 3, 3689-3696

DOI: 10.1021/jacs.5c19806

Uncertainty Quantification in Molecular Machine Learning for Property Predictions under Data Shifts

Authors: Raquel Parrondo-Pizarro, Jessica Lanini, Raquel Rodríguez-Pérez

Journal of Chemical Information and Modeling, 2026, 66, 2, 923-935

DOI: 10.1021/acs.jcim.5c02381

Boosting Reversible Photocontrol of a Photoxenase by an Engineered Conformational Shift

Authors: Sabrina Mandl, Janet Sánchez, Miquel Estévez, Astrid Bruckmann, Caroline Hiefinger, Sílvia Osuna, Andrea Hupfeld

Angewandte Chemie International Edition, 2026, 65, 4

DOI: 10.1002/anie.202518896

Rigidifying Qubit Candidates in a Cu‐Porphyrin Nanohoop: Dipolar Coupling in Spin Pairs and Spin‐Polarized Ground State

Authors: Xingmao Chang, Ashley J. Redman, Linda Zedler, Louis Blechschmidt, Adriana Sacristán‐Martín, Fabian Schwer, Inhar Imaz, Markus P. B. Wiedmaier, Xavi Ribas, Daniel Maspoch, Benjamin Dietzek‐Ivanšić, Sabine Richert, Max von Delius

Angewandte Chemie International Edition, 2026, 65, 4

DOI: 10.1002/anie.202522950

Skeletal Rearrangement of Biaryls via Rhodium-Azirine Intermediate: A Route to Solid-State Emissive Polycyclic Sulfamates

Authors: Nil Insa-Carreras, Àlex Díaz-Jiménez, Andrea Pinto, Laura Rodríguez, Albert Poater, Anna Roglans, Anna Pla-Quintana

ACS Catalysis, 2026, 16, 1, 189-196

DOI: 10.1021/acscatal.5c06179

Atomic Charges via Gradient Boosting: Development and Application for Solvation Energies in Organic Solvents

Authors: Sergei F. Vyboishchikov

Journal of Computational Chemistry, 2026, 47, 2

DOI: 10.1002/jcc.70310

Engineered Leaf‐Branch Compost Cutinase with Enhanced PET Degradation Across a Broad Temperature Range

Authors: Kavita G. Ramnath, Colin T. Pierce, Guillem Casadevall, Silvia Osuna, Jadyn Ide‐Pech, Bryan Zeng, Vishnu Iyer, Romas J. Kazlauskas, Richard A. Gross

ChemSusChem, 2026, 19, 1

DOI: 10.1002/cssc.202501789

Terminal alkyne formation by a pyridoxal phosphate-dependent enzyme

Authors: Jason B. Hedges, Jorge A. Marchand, Carla Calvó-Tusell, Zi-Wang Wei, Douglas C. Millar, Marc Garcia-Borràs, Michelle C. Y. Chang, Katherine S. Ryan

Nature Chemical Biology, 2026, 22, 1, 77-86

DOI: 10.1038/s41589-025-01954-9

Keywords: Biocatalysis, Computational chemistry, Molecular Dynamics interactions

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