A Pan-European Solid-State NMR Infrastructure for Chemistry-Enabling Access

CORDIS oferuje możliwość skorzystania z odnośników do publicznie dostępnych publikacji i rezultatów projektów realizowanych w ramach programów ramowych HORYZONT.

Odnośniki do rezultatów i publikacji związanych z poszczególnymi projektami 7PR, a także odnośniki do niektórych konkretnych kategorii wyników, takich jak zbiory danych i oprogramowanie, są dynamicznie pobierane z systemu OpenAIRE .

Rezultaty

Educational activities

Mid-term (M24) and final reports (M42) on educational activities

Industry-focused activities

Mid-term (M24) and final reports (M42) on industry-focused activities

Stakeholder assembly evaluation reports

Two evaluation reports from the Stakeholder assembly will be provided at M18 and M42

Satellite events

Mid-term (M24) and final reports (M42) on satellite events

New DNP formulations

Report on new DNP formulations and protocols for chemistry-related problems

Solid-state NMR schools

Course materials and course proceedings for the two solid-state NMR schools (M17 and M41)

Annual reports on the access activity

Annual reports on the access activity. First delivered at M12, then regularly updated at M24, M36 and M48

Annual reports on user meetings

Reports on annual user meetings will be delivered yearly starting at M12

Paramagnetic NMR at 100 kHz MAS

Report on new NMR pulse sequences and protocols for 1H detection on paramagnetic samples at 100 kHz MAS

Web-based interface for NMR data

First version of the webbased interface with integrated analytical platform for NMR data analysis and interpretation

On-line user handbook

Online handbook including a frequently ask questions section on project submission protocols for users

Data storage and access

Users guidelines on the data storage and data access

Publikacje

Mobility of lactose in Milk powders

Autorzy: Armin Afrough, Pernille Andersen, Tanja Ninette Angelika Weihrauch, Dennis Wilkens Juhl, Serafim Bakalis, Kirsten Gade Malmos, Thomas Vosegaard
Opublikowane w: Food Research International, Numer 231, 2026, Strona(/y) 118724, ISSN 0963-9969
Wydawca: Elsevier BV
DOI: 10.1016/j.foodres.2026.118724

Atomic-level structure of the amorphous drug atuliflapon via NMR crystallography

Autorzy: Jacob B. Holmes, Daria Torodii, Martins Balodis, Manuel Cordova, Albert Hofstetter, Federico Paruzzo, Sten O. Nilsson Lill, Emma Eriksson, Pierrick Berruyer, Bruno Simões de Almeida, Mike Quayle, Stefan Norberg, Anna Svensk Ankarberg, Staffan Schantz, Lyndon Emsley
Opublikowane w: Faraday Discussions, 2024, ISSN 1359-6640
Wydawca: Royal Society of Chemistry
DOI: 10.1039/d4fd00078a

Systematic Evaluation of Polarizing Agents for Dynamic Nuclear Polarization Enhanced NMR

Autorzy: Ran Wei, Gilles Casano, Yuxuan Zhang, Ivanska M. Gierbolini‐Colón, Yu Rao, Shubha S. Gunaga, Faith J. Scott, Jiaxin Zhou, Satyaki Chatterjee, Sanyog Kumari, Hakim Karoui, Mang Huang, Snorri Th. Sigurdsson, Gaël De Paëpe, Yangping Liu, Frédéric Mentink‐Vigier, Amrit Venkatesh, Olivier Ouari, Lyndon Emsley
Opublikowane w: Angewandte Chemie International Edition, Numer 64, 2025, ISSN 1433-7851
Wydawca: John Wiley & Sons Ltd.
DOI: 10.1002/anie.202505944

Disorder to order: how halide mixing in MAPbI3−xBrx perovskites restricts MA dynamics

Autorzy: Kostas Fykouras, Jonathan Lahnsteiner, Nico Leupold, Paul Tinnemans, Ralf Moos, Fabian Panzer, Gilles A. de Wijs, Menno Bokdam, Helen Grüninger, Arno P. M. Kentgens
Opublikowane w: Journal of Materials Chemistry A, Numer 11, 2024, Strona(/y) 4587-4597, ISSN 2050-7488
Wydawca: Royal Society of Chemistry
DOI: 10.1039/d2ta09069d

Transforming solid-state nuclear magnetic resonance towards a chemistry-ready technique

Autorzy: Raphaële Coulon, David Gajan, Wassilios Papawassiliou, Andrew J. Pell, Judith Schlagnitweit, Franck Fayon, Pierre Florian, Dominique Massiot, Armin Afrough, Dennis W. Juhl, Thomas Vosegaard, Linda Cerofolini, Moreno Lelli, Massimo Lucci, Claudio Luchinat, Ruud L.E.G. Aspers, Jennifer S. Gómez, Arno P.M. Kentgens, Sander F.H. Lambregts, Y.T. Angel Wong, Luís Mafra, Ildefonso Marin-Montesinos, Jo
Opublikowane w: Solid State Nuclear Magnetic Resonance, Numer 140, 2026, Strona(/y) 102048, ISSN 0926-2040
Wydawca: Academic Press
DOI: 10.1016/j.ssnmr.2025.102048

Accessible hybrid DFT-quality NMR crystallography via gas-phase machine learning interatomic potentials

Autorzy: Shubha S. Gunaga, Robert W. Schurko, Sean T. Holmes, Frederic Mentink-Vigier
Opublikowane w: Chemical Science, 2026, ISSN 2041-6520
Wydawca: Royal Society of Chemistry
DOI: 10.1039/d6sc04941a

Unveiling Solvent-Mediated Mechanochemical Cocrystallization Pathways by In Situ CLASSIC NMR Spectroscopy

Autorzy: Anna M. Gołkowska, Maciej Nowak, László Fábián, Dinu Iuga, Franziska Emmerling, Karol P. Nartowski, Bożena Karolewicz, Yaroslav Z. Khimyak
Opublikowane w: Molecular Pharmaceutics, Numer 23, 2026, Strona(/y) 3309-3327, ISSN 1543-8384
Wydawca: American Chemical Society
DOI: 10.1021/acs.molpharmaceut.5c01909

Automated Data Processing Workflows for Non‐Expert Users of NMR Facilities

Autorzy: Armin Afrough, Maria Pérez‐Mendigorri, Thomas Vosegaard
Opublikowane w: Magnetic Resonance in Chemistry, Numer 63, 2025, Strona(/y) 604-612, ISSN 0749-1581
Wydawca: John Wiley & Sons Inc.
DOI: 10.1002/mrc.5540

In situ NMR–guided design of alkaline electrochemical ammonia synthesis

Autorzy: Ruipeng Luo, Anna Bergljót Gunnarsdóttir, Ruud L. E. G. Aspers, Evan Wenbo Zhao
Opublikowane w: Science Advances, Numer 11, 2025, ISSN 2375-2548
Wydawca: American Association for the Advancement of Science (AAAS)
DOI: 10.1126/sciadv.ady8858

Wood decay under anoxia by the brown-rot fungus Fomitopsis pinicola

Autorzy: Robert Röllig, Annie Lebreton, Lucia Grenga, Rosalie Cresswell, Signe Lett, Theodora Tryfona, David Navarro, Julien Lambert, Sacha Grisel, Isabelle Gimbert, Helle Jakobe Martens, Guylaine Miotello, Xiaolan Yu, Elodie Drula, Marie-Noelle Rosso, Lionel Tarrago, Bernard Henrissat, Katja Johansen, Ray Dupree, Jean Armengaud, Paul Dupree, Jean-Guy Berrin
Opublikowane w: Nature Communications, Numer 16, 2025, ISSN 2041-1723
Wydawca: Nature Publishing Group
DOI: 10.1038/s41467-025-62567-3

Developing a Highly Reducing Heterogeneous Nickel Photocatalyst with Photoexcited Hantzsch Esters

Autorzy: Ming Cui, Deyang Wang, Jun Guo, Minhui Dai, Meng-Ying Sun, Zekun Li, Ching Kit Tommy Wun, Stephanie Bachmann, Wing Ying Chow, Tsz Woon Benedict Lo, Meng Zhou, Wen Wu Xu, Jian He
Opublikowane w: Journal of the American Chemical Society, Numer 147, 2025, Strona(/y) 32982-32993, ISSN 0002-7863
Wydawca: American Chemical Society
DOI: 10.1021/jacs.5c10198

Deuterated TEKPol Biradicals and the Spin‐Diffusion Barrier in MAS DNP

Autorzy: Amrit Venkatesh, Gilles Casano, Yu Rao, Federico De Biasi, Frédéric A. Perras, Dominik J. Kubicki, Didier Siri, Sébastien Abel, Hakim Karoui, Maxim Yulikov, Olivier Ouari, Lyndon Emsley
Opublikowane w: Angewandte Chemie International Edition, Numer 62, 2023, ISSN 1433-7851
Wydawca: John Wiley & Sons Ltd.
DOI: 10.1002/anie.202304844

Composition and Structure of the solid electrolyte interphase on Na-Ion Anodes Revealed by Exo- and Endogenous Dynamic Nuclear Polarization─NMR Spectroscopy

Autorzy: Yuval Steinberg, Elias Sebti, Ilia B. Moroz, Arava Zohar, Daniel Jardón-Álvarez, Tatyana Bendikov, Ayan Maity, Raanan Carmieli, Raphaële J. Clément, Michal Leskes
Opublikowane w: Journal of the American Chemical Society, Numer 146, 2024, Strona(/y) 24476-24492, ISSN 0002-7863
Wydawca: American Chemical Society
DOI: 10.1021/jacs.4c06823

Investigation of holocellulose, lignin, and plasticizer interactions and their effect on the thermoformability of plasticized kraft pulp studied by ssNMR, O-PTIR and SAXS/WAXS

Autorzy: Åke Henrik-Klemens, Stephanie Bachmann, Dinu Iuga, Anette Larsson
Opublikowane w: Carbohydrate Polymers, Numer 379, 2026, Strona(/y) 125002, ISSN 0144-8617
Wydawca: Pergamon Press Ltd.
DOI: 10.1016/j.carbpol.2026.125002

Mechanism of Solid-State 1H Photochemically Induced Dynamic Nuclear Polarization in a Synthetic Donor–Chromophore–Acceptor at 0.3 T

Autorzy: Marcel Levien, Federico De Biasi, Ganesan Karthikeyan, Gilles Casano, Máté Visegrádi, Olivier Ouari, Lyndon Emsley
Opublikowane w: The Journal of Physical Chemistry Letters, Numer 15, 2024, Strona(/y) 11097-11103, ISSN 1948-7185
Wydawca: American Chemical Society
DOI: 10.1021/acs.jpclett.4c02805

Overhauser Dynamic Nuclear Polarization of Lithiated Graphite Anodes: Probing Bulk and Surface Structures

Autorzy: Teresa Insinna, Anne-Laure Barra, Clare P. Grey
Opublikowane w: Chemistry of Materials, Numer 37, 2025, Strona(/y) 5167-5182, ISSN 0897-4756
Wydawca: American Chemical Society
DOI: 10.1021/acs.chemmater.5c00845

Impact of ring-opening chemistry on the local chain mobility of arabinoxylan

Autorzy: Ratchawit Janewithayapun, Hampus Karlsson, Mikael S. Hedenqvist, Dennis Wilkens Juhl, Thomas Vosegaard, Lars Evenäs, Anna Ström
Opublikowane w: Carbohydrate Polymers, Numer 392, 2026, Strona(/y) 125873, ISSN 0144-8617
Wydawca: Pergamon Press Ltd.
DOI: 10.1016/j.carbpol.2026.125873

Two‐dimensional Pure Isotropic Proton Solid State NMR

Autorzy: Pinelopi Moutzouri, Manuel Cordova, Bruno Simões de Almeida, Daria Torodii, Lyndon Emsley
Opublikowane w: Angewandte Chemie International Edition, Numer 62, 2024, ISSN 1433-7851
Wydawca: John Wiley & Sons Ltd.
DOI: 10.1002/anie.202301963

Covalent connectivity of glycogen in brewer's spent yeast cell walls revealed by enzymatic approaches and dynamic nuclear polarization NMR

Autorzy: Rita Bastos, Ildefonso Marín-Montesinos, Sónia S. Ferreira, Frédéric Mentink-Vigier, Mariana Sardo, Luís Mafra, Manuel A. Coimbra, Elisabete Coelho
Opublikowane w: Carbohydrate Polymers, Numer 324, 2024, Strona(/y) 121475, ISSN 0144-8617
Wydawca: Pergamon Press Ltd.
DOI: 10.1016/j.carbpol.2023.121475

A Lightweight Beryllium Metal–Organic Framework for Combined Physical and Chemical Hydrogen Storage

Autorzy: Giacomo Provinciali, Naomi Anna Consoli, Martino Degli Innocenti, Anna Moliterni, Heryson Tresmann, Rocco Caliandro, Cinzia Giannini, Rolando Pedicini, Giuliano Giambastiani, Giulia Tuci, Moreno Lelli, Andrea Rossin
Opublikowane w: ACS Applied Energy Materials, Numer 8, 2025, Strona(/y) 16891-16903, ISSN 2574-0962
Wydawca: American Chemical Society (ACS)
DOI: 10.1021/acsaem.5c02864

Optically Enhanced Solid-State 1H NMR Spectroscopy

Autorzy: Federico De Biasi, Michael A. Hope, Claudia E. Avalos, Ganesan Karthikeyan, Gilles Casano, Aditya Mishra, Saumya Badoni, Gabriele Stevanato, Dominik J. Kubicki, Jonas Milani, Jean-Philippe Ansermet, Aaron J. Rossini, Moreno Lelli, Olivier Ouari, Lyndon Emsley
Opublikowane w: Journal of the American Chemical Society, Numer 145, 2023, Strona(/y) 14874-14883, ISSN 0002-7863
Wydawca: American Chemical Society
DOI: 10.1021/jacs.3c03937

Natural abundance 195Pt-13C correlation NMR spectroscopy on surfaces enabled by fast MAS dynamic nuclear polarization

Autorzy: Zhuoran Wang, Thomas C. Robinson, Domenico Gioffrè, Rochlitz Lukas, David Gajan, Aaron J. Rossini, Christophe Copéret, Anne Lesage
Opublikowane w: Journal of Magnetic Resonance Open, Numer 21, 2026, Strona(/y) 100167, ISSN 2666-4410
Wydawca: Elsevier BV
DOI: 10.1016/j.jmro.2024.100167

From Chalcogen Bonding to S–π Interactions in Hybrid Perovskite Photovoltaics

Autorzy: Weifan Luo, SunJu Kim, Nikolaos Lempesis, Lena Merten, Ekaterina Kneschaurek, Mathias Dankl, Virginia Carnevali, Lorenzo Agosta, Vladislav Slama, Zachary VanOrman, Miłosz Siczek, Wojciech Bury, Benjamin Gallant, Dominik J. Kubicki, Michal Zalibera, Laura Piveteau, Marielle Deconinck, L. Andrés Guerrero‐León, Aaron T. Frei, Patricia A. Gaina, Eva Carteau, Paul Zimmermann, Alexander Hinderhofer
Opublikowane w: Advanced Science, Numer 11, 2024, ISSN 2198-3844
Wydawca: Advanced Science
DOI: 10.1002/advs.202405622

Coordination environments of Pt single-atom catalysts from NMR signatures

Autorzy: Jonas Koppe, Alexander V. Yakimov, Domenico Gioffrè, Marc-Eduard Usteri, Thomas Vosegaard, Guido Pintacuda, Anne Lesage, Andrew J. Pell, Sharon Mitchell, Javier Pérez-Ramírez, Christophe Copéret
Opublikowane w: Nature, Numer 642, 2025, Strona(/y) 613-619, ISSN 0028-0836
Wydawca: Nature Publishing Group
DOI: 10.1038/s41586-025-09068-x

Optimal sensitivity for 1H detected relayed DNP of organic solids at fast MAS

Autorzy: Saumya Badoni, Pierrick Berruyer, Lyndon Emsley
Opublikowane w: Journal of Magnetic Resonance, Numer 360, 2024, Strona(/y) 107645, ISSN 1090-7807
Wydawca: Academic Press
DOI: 10.1016/j.jmr.2024.107645

Moving NMR infrastructures to remote access capabilities

Autorzy: James Tolchard, Tanguy Le Marchand, Ruud L.E.G. Aspers, Gyula Batta, Burkhard Bechinger, Ulrika Brath, Styliani A. Chasapi, Ana Čikoš, Kornél Ecsedi, Adrien Favier, Ana Sofia D. Ferreira, Radovan Fiala, Panagiota D. Georgiopoulou, Jennifer S. Gómez, Kristaps Jaudzems, Göran Karlsson, Arno P.M. Kentgens, Sander F.H. Lambregts, Francesca Morelli, Frans A.A. Mulder, Sivanandam V. Natarajan, Ceci
Opublikowane w: Progress in Nuclear Magnetic Resonance Spectroscopy, Numer 152-153, 2026, Strona(/y) 101595, ISSN 0079-6565
Wydawca: Elsevier BV
DOI: 10.1016/j.pnmrs.2026.101595

Solid State Machinery of Multiple Dynamic Elements in a Metal–Organic Framework

Autorzy: Jacopo Perego, Andrea Daolio, Charl X. Bezuidenhout, Sergio Piva, Giacomo Prando, Benjamin Costarella, Pietro Carretta, Luciano Marchiò, Dominik Kubicki, Piero Sozzani, Silvia Bracco, Angiolina Comotti
Opublikowane w: Angewandte Chemie International Edition, Numer 63, 2024, ISSN 1433-7851
Wydawca: John Wiley & Sons Ltd.
DOI: 10.1002/anie.202317094

Exploring Tyramine's Role in the Formation of Supramolecular Adducts with Nonsteroidal Anti‐Inflammatory Drugs

Autorzy: Chiara Rosso, Rebecca Birolo, Angelo Gallo, William T. Franks, Emanuele Priola, Michele R. Chierotti, Roberto Gobetto
Opublikowane w: Chemistry – A European Journal, Numer 31, 2025, ISSN 0947-6539
Wydawca: John Wiley & Sons Ltd.
DOI: 10.1002/chem.202500080

Determination of the Na3AlF6–Y2O3 Phase Diagram and Its Implications for Low-Temperature YAG/Nd:YAG Synthesis

Autorzy: Michal Korenko, František Šimko, Mathieu Allix, Aydar Rakhmatullin, Michael J. Pitcher, Graham King
Opublikowane w: Crystal Growth & Design, Numer 24, 2024, Strona(/y) 7494-7503, ISSN 1528-7483
Wydawca: American Chemical Society
DOI: 10.1021/acs.cgd.4c00684

Direct Determination of Carrier Parameters in Indium Tin Oxide Nanocrystals

Autorzy: Alessio Gabbani, Elisa Della Latta, Ananthakrishnan Mohan, Andrea Scarperi, Xiaoyan Li, Marina Ruggeri, Francesca Martini, Francesco Biccari, Mathieu Kociak, Marco Geppi, Silvia Borsacchi, Francesco Pineider
Opublikowane w: ACS Nano, Numer 18, 2024, Strona(/y) 15139-15153, ISSN 1936-0851
Wydawca: American Chemical Society
DOI: 10.1021/acsnano.4c02875

Local Structure and Surface Acidity of Overlayers Prepared by Atomic Layer Deposition of Silica on Alumina

Autorzy: Melis Yarar, Zixuan Chen, Diana Piankova, Matthias Becker, Alexander V. Yakimov, Christophe Copéret, Pierre Florian, Christoph R. Müller, Alexey Fedorov
Opublikowane w: Chemistry of Materials, Numer 37, 2025, Strona(/y) 7974-7986, ISSN 0897-4756
Wydawca: American Chemical Society
DOI: 10.1021/acs.chemmater.5c01832

Unravelling the Molecular Structure and Confining Environment of an Organometallic Catalyst Heterogenized within Amorphous Porous Polymers**

Autorzy: Ribal Jabbour, Christopher W. Ashling, Thomas C. Robinson, Arafat Hossain Khan, Dorothea Wisser, Pierrick Berruyer, Ashta C. Ghosh, Alisa Ranscht, David A. Keen, Eike Brunner, Jérôme Canivet, Thomas D. Bennett, Caroline Mellot‐Draznieks, Anne Lesage, Florian M. Wisser
Opublikowane w: Angewandte Chemie International Edition, Numer 62, 2023, ISSN 1433-7851
Wydawca: John Wiley & Sons Ltd.
DOI: 10.1002/anie.202310878

Probing the heterogeneous amorphous network of silicoaluminophosphate binders by advanced multidimensional multinuclear SSNMR and DFT modeling

Autorzy: Davide Bernasconi, Simone Bordignon, Pierre Florian, Franck Fayon, Annalisa Pallini, Geo Paul, Janez Volavšek, Nadia Curetti, Alfonso Pedone, Roberto Gobetto, Alessandro Pavese, Alberto Viani
Opublikowane w: Journal of Non-Crystalline Solids, Numer 681, 2026, Strona(/y) 124054, ISSN 0022-3093
Wydawca: Elsevier BV
DOI: 10.1016/j.jnoncrysol.2026.124054

17O-1H correlation NMR spectroscopy provides accessible and direct insights into CO2 capture chemistry

Autorzy: Benjamin J. Rhodes, Jennifer S. Gómez, Jordon S. Hilliard, Lars L. Schaaf, Casey R. Wade, Alexander C. Forse
Opublikowane w: Solid State Nuclear Magnetic Resonance, Numer 143, 2026, Strona(/y) 102077, ISSN 0926-2040
Wydawca: Academic Press
DOI: 10.1016/j.ssnmr.2026.102077

Pushingthe Boundaries of Resolution in Solid-StateNuclear Magnetic Resonance of Biomolecules with 160 kHz Magic-AngleSpinning

Autorzy: Zhiyu Sun, Claire Ollier, Adrienn Rancz, Batiste Thienpont, Kristof Grohe, Lukas Becker, Armin Purea, Frank Engelke, Sebastian Wegner, James Sturgis, Tatyana Polenova, Tanguy Le Marchand, Guido Pintacuda
Opublikowane w: Journal of the American Chemical Society, Numer 147, 2026, Strona(/y) 19433-19437, ISSN 0002-7863
Wydawca: American Chemical Society
DOI: 10.1021/jacs.5c02466

Efficient DNP at high fields and fast MAS with antenna-sensitized dinitroxides

Autorzy: Lorenzo Niccoli, Gilles Casano, Georges Menzildjian, Maxim Yulikov, Thomas Robinson, Salah-Eddine Akrial, Zhuoran Wang, Christian Reiter, Armin Purea, Didier Siri, Amrit Venkatesh, Lyndon Emsley, David Gajan, Moreno Lelli, Olivier Ouari, Anne Lesage
Opublikowane w: Chemical Science, Numer 15, 2026, Strona(/y) 16582-16593, ISSN 2041-6520
Wydawca: Royal Society of Chemistry
DOI: 10.1039/d4sc04473h

Ligand-Aided Glycolysis of PET Using Functionalized Silica-Supported Fe2O3 Nanoparticles

Autorzy: Éadaoin Casey, Rachel Breen, Jennifer S. Gómez, Arno P. M. Kentgens, Gerard Pareras, Albert Rimola, Justin. D. Holmes, Gillian Collins
Opublikowane w: ACS Sustainable Chemistry & Engineering, Numer 11, 2023, Strona(/y) 15544-15555, ISSN 2168-0485
Wydawca: American Chemical Society
DOI: 10.1021/acssuschemeng.3c03585

Spin Hyperpolarization in Modern Magnetic Resonance

Autorzy: James Eills, Dmitry Budker, Silvia Cavagnero, Eduard Y. Chekmenev, Stuart J. Elliott, Sami Jannin, Anne Lesage, Jörg Matysik, Thomas Meersmann, Thomas Prisner, Jeffrey A. Reimer, Hanming Yang, Igor V. Koptyug
Opublikowane w: Chemical Reviews, Numer 123, 2023, Strona(/y) 1417-1551, ISSN 0009-2665
Wydawca: American Chemical Society
DOI: 10.1021/acs.chemrev.2c00534

Crystal structure validation of verinurad via proton-detected ultra-fast MAS NMR and machine learning

Autorzy: Daria Torodii, Jacob B. Holmes, Pinelopi Moutzouri, Sten O. Nilsson Lill, Manuel Cordova, Arthur C. Pinon, Kristof Grohe, Sebastian Wegner, Okky Dwichandra Putra, Stefan Norberg, Anette Welinder, Staffan Schantz, Lyndon Emsley
Opublikowane w: Faraday Discussions, 2024, ISSN 1359-6640
Wydawca: Royal Society of Chemistry
DOI: 10.1039/d4fd00076e

Off-the-Shelf Gd(NO3)3 as an Efficient High-Spin Metal Ion Polarizing Agent for Magic Angle Spinning Dynamic Nuclear Polarization

Autorzy: Stuart J.Elliott
Opublikowane w: Journal of Physical Chemistry B, 2022, ISSN 1520-6106
Wydawca: American Chemical Society
DOI: 10.1021/acs.jpcb.2c04184

To Stop or to Shuttle Halides? The Role of an Ionic Liquid in Thermal Halide Mixing of Hybrid Perovskites

Autorzy: Christopher Greve, Philipp Ramming, Markus Griesbach, Nico Leupold, Ralf Moos, Anna Köhler, Eva M. Herzig, Fabian Panzer, Helen Grüninger
Opublikowane w: ACS Energy Letters, Numer 8, 2023, Strona(/y) 5041-5049, ISSN 2380-8195
Wydawca: American Chemical Society
DOI: 10.1021/acsenergylett.3c01878

An antibiotic from an uncultured bacterium binds to an immutable target

Autorzy: Rhythm Shukla, Aaron J. Peoples, Kevin C. Ludwig, Sourav Maity, Maik G.N. Derks, Stefania De Benedetti, Annika M. Krueger, Bram J.A. Vermeulen, Theresa Harbig, Francesca Lavore, Raj Kumar, Rodrigo V. Honorato, Fabian Grein, Kay Nieselt, Yangping Liu, Alexandre M.J.J. Bonvin, Marc Baldus, Ulrich Kubitscheck, Eefjan Breukink, Catherine Achorn, Anthony Nitti, Christopher J. Schwalen, Amy L. Spoering,
Opublikowane w: Cell, Numer 186, 2023, Strona(/y) 4059-4073.e27, ISSN 0092-8674
Wydawca: Cell Press
DOI: 10.1016/j.cell.2023.07.038

Epitope Mapping and Binding Assessment by Solid-State NMR Provide a way for the Development of Biologics under the Quality by Design Paradigm

Autorzy: Rizzo D. - Cerofolini L. - Giuntini S. - Iozzino L. - Pergola C. - Sacco F. - Palmese A. - Ravera E. - Luchinat C. - Baroni F. - Fragai M.
Opublikowane w: Journal of the American Chemical Society, 2022, ISSN 0002-7863
Wydawca: American Chemical Society
DOI: 10.1021/jacs.2c03232

Metal Ion Dynamic Nuclear Polarization in Mn(II)-Doped CdS Nanocrystals: Atomic-Scale Investigation of the Dopant and Its Host

Autorzy: Ran Eitan Abutbul, Daniel Jardon-Alvarez, Lothar Houben, Ofra Golani, Ehud Sivan, Raanan Carmieli, Ilia Kaminker, Michal Leskes
Opublikowane w: ACS Nano, Numer 19, 2025, Strona(/y) 17640-17652, ISSN 1936-0851
Wydawca: American Chemical Society
DOI: 10.1021/acsnano.5c01257

Capturing and labeling CO 2 in a jar: mechanochemical 17 O-enrichment and ssNMR study of sodium and potassium (bi)carbonate salts

Autorzy: Austin Peach, Nicolas Fabregue, Célia Erre, Thomas-Xavier Métro, David Gajan, Frédéric Mentink-Vigier, Faith Scott, Julien Trébosc, Florian Voron, Nicolas Patris, Christel Gervais, Danielle Laurencin
Opublikowane w: Chemical Science, Numer 16, 2026, Strona(/y) 10731-10741, ISSN 2041-6520
Wydawca: Royal Society of Chemistry
DOI: 10.1039/d4sc08491h

Isotropic Hyperfine Interactions Drive Cross-Effect Dynamic Nuclear Polarization

Autorzy: Nitzan Livni, Subhradip Paul, Ilia B. Moroz, Alexey V. Bogdanov, Daniel Jardón-Álvarez, Frederic Mentink-Vigier, Michal Leskes
Opublikowane w: The Journal of Physical Chemistry Letters, Numer 16, 2025, Strona(/y) 11955-11963, ISSN 1948-7185
Wydawca: American Chemical Society
DOI: 10.1021/acs.jpclett.5c02845

Host defence peptide plectasin targets bacterial cell wall precursor lipid II by a calcium-sensitive supramolecular mechanism

Autorzy: Shehrazade Jekhmane, Maik G. N. Derks, Sourav Maity, Cornelis J. Slingerland, Kamaleddin H. M. E. Tehrani, João Medeiros-Silva, Vicky Charitou, Danique Ammerlaan, Céline Fetz, Naomi A. Consoli, Rachel V. K. Cochrane, Eilidh J. Matheson, Mick van der Weijde, Barend O. W. Elenbaas, Francesca Lavore, Ruud Cox, Joseph H. Lorent, Marc Baldus, Markus Künzler, Moreno Lelli, Stephen A. Cochrane, Nathan
Opublikowane w: Nature Microbiology, Numer 9, 2024, Strona(/y) 1778-1791, ISSN 2058-5276
Wydawca: Nature Microbiology
DOI: 10.1038/s41564-024-01696-9

Confinement Effects on the Rh III Cp* / Polyoxometalate System in Photochemical CO 2 Reduction Reactions: Porous Organic Polymer Versus Metal–Organic Framework

Autorzy: Alisa Ranscht, Albert Solé‐Daura, Thomas C. Robinson, Ashta C. Ghosh, Youven Benseghir, Mohammed H. Alkhurisi, Rebecca E. Reber, Emilien Chaigne‐Tarlotin, Pauline Bredy, Elsje Alessandra Quadrelli, Anne Lesage, Jérôme Canivet, Caroline Mellot‐Draznieks, Florian M. Wisser
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Ammonia Borane and Hydrazine Bis(borane) Confined within Zirconium Bithiazole and Bipyridyl Metal–Organic Frameworks as Chemical Hydrogen Storage Materials

Autorzy: Giacomo Provinciali, Naomi Anna Consoli, Rocco Caliandro, Vincenzo Mangini, Luisa Barba, Cinzia Giannini, Giulia Tuci, Giuliano Giambastiani, Moreno Lelli, Andrea Rossin
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Soliton Based Dynamic Nuclear Polarization: An Overhauser Effect in Cyclic Polyacetylene at High Field and Room Temperature

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Structure and Dynamics of Paramagnetic Iron(II) Sites from the DFT-Assisted Solid-State NMR of Molecular and Surface Species

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Aluminium siting in zeolite RTH from a combined machine learning – NMR approach

Autorzy: Daniel Willimetz, Joaquin Martínez-Ortigosa, Deborah Brako-Amoafo, Lukáš Grajciar, J. Alejandro Vidal-Moya, Carlos Bornes, Vincent Sarou-Kanian, Fernando Rey, Teresa Blasco, Christopher J. Heard
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A Dynamically Induced Phase Transition in Na4P2S6─Ultrafast Na+ Mobility Triggering Rotor Phase Formation

Autorzy: Katharina Hogrefe, Bernhard Gadermaier, Christian Schneider, Sebastian Bette, Bettina V. Lotsch, H. Martin R. Wilkening
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Light-Induced 1H NMR Hyperpolarization in Solids at 9.4 and 21.1 T

Autorzy: Federico De Biasi, Ganesan Karthikeyan, Máté Visegrádi, Marcel Levien, Michael A. Hope, Paige J. Brown, Michael R. Wasielewski, Olivier Ouari, Lyndon Emsley
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A practical guide to metal ions dynamic nuclear polarization in materials science

Autorzy: Ilia B. Moroz, Neta Katzav, Asya Svirinovsky-Arbeli, Michal Leskes
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Combining Solid‐State NMR with Structural and Biophysical Techniques to Design Challenging Protein‐Drug Conjugates

Autorzy: Linda Cerofolini, Kristian Vasa, Elisa Bianconi, Maria Salobehaj, Giulia Cappelli, Alice Bonciani, Giulia Licciardi, Anna Pérez‐Ràfols, Luis Padilla‐Cortés, Sabrina Antonacci, Domenico Rizzo, Enrico Ravera, Caterina Viglianisi, Vito Calderone, Giacomo Parigi, Claudio Luchinat, Antonio Macchiarulo, Stefano Menichetti, Marco Fragai
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13C solid-state NMR chemical shift reproducibility across spectrometers

Autorzy: Erika Bartůňková, Jan Blahut, Renée Siegel, Dinu Iuga, Jürgen Senker, Marta K. Dudek, Martin Dračínský
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Revealing the Low-Temperature Phase of FAPbI3 Using a Machine-Learned Potential

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Extending numerical simulations in SIMPSON: Electron paramagnetic resonance, dynamic nuclear polarisation, propagator splitting, pulse transients, and quadrupolar cross terms

Autorzy: David L. Goodwin, José P. Carvalho, Anders B. Nielsen, Nino Wili, Andreas Brinkmann, Thomas Vosegaard, Zdeněk Tošner, Niels Chr. Nielsen
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Bugs on Drugs: Paracetamol Exposure Reveals Genotype-Specific Generational Effects on Life History Traits in Drosophila melanogaster

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Barriers to resolution in 1H NMR of rotating solids

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Leucopterin, the white pigment in butterfly wings: structural analysis by PDF fit, FIDEL fit, Rietveld refinement, solid-state NMR and DFT-D

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On the Accessibility of Higher‐ n Phases in Formamidinium‐Based Ruddlesden‐Popper and Dion–Jacobson Layered Hybrid Perovskites

Autorzy: Ghewa AlSabeh, Vladislav Slama, Masaud Almalki, Lena Merten, Paul Zimmermann, Alexander Hinderhofer, Pascal Alexander Schouwink, Virginia Carnevali, Nikolaos Lempesis, Lorenzo Agosta, Frank Schreiber, Ursula Rothlisberger, Michael Grätzel, Jovana V. Milić
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Heteronuclear decoupling with rotor-synchronized phase-alternated cycles

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Aryl‐Acetylene Layered Hybrid Perovskites in Photovoltaics

Autorzy: Ghewa AlSabeh, Vladislav Slama, Ming Ren, Masaud Almalki, Lukas Pfeifer, Dominik J. Kubicki, Paul Zimmermann, Alexander Hinderhofer, Fabiola Faini, Davide Moia, Mostafa Othman, Felix T. Eickemeyer, Virginia Carnevali, Nikolaos Lempesis, Andrea Vezzosi, Fatemeh Ansari, Frank Schreiber, Joachim Maier, Christian M. Wolff, Aïcha Hessler‐Wyser, Christophe Ballif, Giulia Grancini, Ursula Rothlisberge
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Indirect Detectionof the Protons in and around Biradicalsand their Mechanistic Role in MAS-DNP

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Molecular and Electronic Structure of Isolated Platinum Sites Enabled by the Expedient Measurement of 195 Pt Chemical Shift Anisotropy

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Characterizing 13C Spectral Assignments and Substituent Distributions of Hydroxypropylmethylcellulose Acetyl Succinate Using Dynamic Nuclear Polarization Nuclear Magnetic Resonance Spectroscopy

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Salt/Co‐Crystal Discrimination Made Easy by 17O Solid‐State NMR

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Structure and Carbon Dioxide Adsorption Properties of a Nanosized Aluminum <scp>l</scp> -Aspartate Metal–Organic Framework

Autorzy: Letizia Trovarelli, Virginia Guiotto, Maria Sole Notari, Lorenzo Isidoro, Giacomo Provinciali, Concetta Bafaro, Andrea Rossin, Martino Degli Innocenti, Naomi Anna Consoli, Moreno Lelli, Marco Taddei, Matteo Signorile, Valentina Crocellà, Ferdinando Costantino
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Speciation and Structures in Pt Surface Sites Stabilized by N-Heterocyclic Carbene Ligands Revealed by Dynamic Nuclear Polarization Enhanced Indirectly Detected 195Pt NMR Spectroscopic Signatures and Fingerprint Analysis

Autorzy: Z. R. Wang - L. A. Volker - T. C. Robinson - N. Kaeffer - G. Menzildjian - R. Jabbour - A. Venkatesh - D. Gajan - A. J. Rossini - C. Coperet - A. Lesage
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Rational Design of Dinitroxide Polarizing Agents for Dynamic Nuclear Polarization to Enhance Overall NMR Sensitivity

Autorzy: Amrit Venkatesh, Gilles Casano, Ran Wei, Yu Rao, Hugo Lingua, Hakim Karoui, Maxim Yulikov, Olivier Ouari, Lyndon Emsley
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Impact of shared facilities in advancing solid-state NMR research: 2025 edition

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PyrroTriPol: A Semi-Rigid Trityl-Nitroxide for High Field Dynamic Nuclear Polarization

Autorzy: Halbritter, T. - Harrabi, R. - Paul, S.- van Tol, J. - Lee, D. - Hediger, S.- Sigurdsson, S.- Mentink-Vigier, F. - Paepe, G.,
Opublikowane w: Royal Society of Chemistry, 2023, ISSN 1473-7604
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Magic angle spinning effects on longitudinal NMR relaxation: 15N in L-histidine

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Polarizing agents for efficient high field DNP solid-state NMR spectroscopy under magic-angle spinning: from design principles to formulation strategies

Autorzy: Georges Menzildjian, Judith Schlagnitweit, Gilles Casano, Olivier Ouari, David Gajan, Anne Lesage
Opublikowane w: Chemical Science, Numer 14, 2024, Strona(/y) 6120-6148, ISSN 2041-6520
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Cesium Oxo-fluoro-aluminates in the CsF–Al2O3 System: Synthesis and Structural Characterization

Autorzy: František Šimko, Aydar Rakhmatullin, Graham King, Mathieu Allix, Catherine Bessada, Zuzana Netriová, Dhiya Krishnan, Michal Korenko
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Three-Dimensional Atomic-Level Structure of an Amorphous Glucagon-Like Peptide-1 Receptor Agonist

Autorzy: Daria Torodii, Manuel Cordova, Jacob B. Holmes, Pinelopi Moutzouri, Tommaso Casalini, Sten O. Nilsson Lill, Arthur C. Pinon, Christopher S. Knee, Anna Svensk Ankarberg, Okky Dwichandra Putra, Staffan Schantz, Lyndon Emsley
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Endogenous metal-ion dynamic nuclear polarization for NMR signal enhancement in metal organic frameworks

Autorzy: Ilia B. Moroz, Yishay Feldman, Raanan Carmieli, Xinyu Liu, Michal Leskes
Opublikowane w: Chemical Science, Numer 15, 2024, Strona(/y) 336-348, ISSN 2041-6520
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Observation of 1H-1H J-couplings in fast magic-angle-spinning solid-state NMR spectroscopy

Autorzy: Daria Torodii, Jacob B. Holmes, Kristof Grohe, Rodrigo de Oliveira-Silva, Sebastian Wegner, Dimitrios Sakellariou, Lyndon Emsley
Opublikowane w: Nature Communications, Numer 15, 2024, ISSN 2041-1723
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17O solid state NMR as a valuable tool for deciphering reaction mechanisms in mechanochemistry: the case study on the 17 O-enrichment of hydrated Ca-pyrophosphate biominerals

Autorzy: Ieva Goldberga; Nicholai D. Jensen; Christèle Combes; Frédéric Mentink-Vigier; Xiaoling Wang; Ivan Hung; Zhehong Gan; Julien Trébosc; Thomas-Xavier Métro; Christian Bonhomme; Christel Gervais; Danielle Laurencin
Opublikowane w: Faraday Discussions, 2022, ISSN 1473-7604
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Maximizing Relayed 1H Hyperpolarization Transfer by Slow-Fast MAS NMR Spectroscopy

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Multitasking Pharmacophores Support Cabotegravir-Based Long-Acting HIV Pre-Exposure Prophylaxis (PrEP)

Autorzy: Zheng Wan, Man Shi, Yanqing Gong, Massimo Lucci, Jinjin Li, Jiahai Zhou, Xiao-Liang Yang, Moreno Lelli, Xiao He, Jiafei Mao
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Readily Accessible bTurea‐Derived Nitroxide Polarizing Agents for Dynamic Nuclear Polarization: bcTCOOKs and bcTmols

Autorzy: Ancy T. Wilson, Shubha S. Gunaga, Frederic Mentink‐Vigier, Snorri Th. Sigurdsson
Opublikowane w: Chemistry – A European Journal, 2026, ISSN 0947-6539
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Lifetime distribution of multiexponential recovery processes

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Opublikowane w: Physical Review Applied, Numer 25, 2026, ISSN 2331-7019
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1H–19F cross-polarization magic angle spinning dynamic nuclear polarization NMR investigation of advanced pharmaceutical formulations

Autorzy: Mária Šoltésová, Arthur C. Pinon, Fabien Aussenac, Judith Schlagnitweit, Christian Reiter, Armin Purea, Roberto Melzi, Frank Engelke, Dave Martin, Stefanie Krambeck, Annabelle Biscans, Emma Kay, Lyndon Emsley, Staffan Schantz
Opublikowane w: Journal of Magnetic Resonance, Numer 371, 2025, Strona(/y) 107827, ISSN 1090-7807
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Peculiar Phosphonate Modifications of Velvet Worm Slime Revealed by Advanced Nuclear Magnetic Resonance and Mass Spectrometry

Autorzy: Alexandre Poulhazan, Alexander Baer, Gagan Daliaho, Frederic Mentink-Vigier, Alexandre A. Arnold, Darren C. Browne, Lars Hering, Stephanie Archer-Hartmann, Lauren E. Pepi, Parastoo Azadi, Stephan Schmidt, Georg Mayer, Isabelle Marcotte, Matthew J. Harrington
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Leveraging mesoporosity and acidity in interzeolite transformation intermediates for plastic waste valorization

Autorzy: Joaquin Martínez-Ortigosa, Karolina A. Tarach, Oliwia Rogala, Noemi Linares, Kinga Góra-Marek, Javier García-Martínez
Opublikowane w: Applied Catalysis B: Environment and Energy, Numer 379, 2026, Strona(/y) 125685, ISSN 0926-3373
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Reversible transformation of sub-nanometer Ga-based clusters to isolated [4]Ga(4Si) sites creates active centers for propane dehydrogenation

Autorzy: Zixuan Chen, Alexander I. Serykh, Agnieszka Kierzkowska, David Gajan, Scott R. Docherty, Alexander V. Yakimov, Paula M. Abdala, Christophe Copéret, Pierre Florian, Alexey Fedorov, Christoph R. Müller
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Solid Effect Dynamic Nuclear Polarization Enhancement of >500 at 9.4 T

Autorzy: Ran Wei, Yu Rao, Amrit Venkatesh, Lyndon Emsley
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Resolving Structures of Paramagnetic Systems in Chemistry and Materials Science by Solid‐State NMR: The Revolving Power of Ultra‐Fast MAS

Autorzy: Jonas Koppe, Kevin J. Sanders, Thomas C. Robinson, Arthur L. Lejeune, David Proriol, Sebastian Wegner, Armin Purea, Frank Engelke, Raphaële J. Clément, Clare P. Grey, Andrew J. Pell, Guido Pintacuda
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Magic Angle Spinning Solid-State 13C Photochemically Induced Dynamic Nuclear Polarization by a Synthetic Donor–Chromophore–Acceptor System at 9.4 T

Autorzy: Federico De Biasi, Michael A. Hope, Yunfan Qiu, Paige J. Brown, Máté Visegrádi, Olivier Ouari, Michael R. Wasielewski, Lyndon Emsley
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Solid-state NMR - a complementary technique for protein framework characterization

Autorzy: L. Cerofolini, K. O. Ramberg, L. C. Padilla, P. Antonik, E. Ravera, C. Luchinat, M. Fragai, P. B. Crowley
Opublikowane w: Chemical Communications, 2023, ISSN 1359-7345
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The role of spin diffusion in endogenous metal ions DNP

Autorzy: Ilia B. Moroz, Daniel Jardón-Álvarez, Michal Leskes
Opublikowane w: The Journal of Chemical Physics, Numer 162, 2025, ISSN 0021-9606
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Phase distortion-free paramagnetic NMR spectra

Autorzy: E. Ravera
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Sorbitol-Based Glass Matrices Enable Dynamic Nuclear Polarization beyond 200 K

Autorzy: Faith J. Scott, Samuel Eddy, Terry Gullion, Frédéric Mentink-Vigier
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Enhancing half-integer quadrupolar solid-state NMR signals via steady states: A double frequency sweep-based approach

Autorzy: Y. T. Angel Wong, Mattia Negroni, Arno P. M. Kentgens
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