Highly Informative Drug Screening by Overcoming NMR Restrictions

Project Information

HiSCORE

Grant agreement ID: 951459

DOI 10.3030/951459

EC signature date 8 April 2021

Start date 1 May 2021

End date 30 April 2027

Funded under

• EXCELLENT SCIENCE - European Research Council (ERC)

Total cost € 13 992 719,00

EU contribution € 13 992 719,00

Coordinated by

ECOLE NORMALE SUPERIEURE
France

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Links to deliverables and publications from FP7 projects, as well as links to some specific result types such as dataset and software, are dynamically retrieved from OpenAIRE .

Publications

Peer reviewed articles (11)

Drug Screening of Achiral Molecules by Long-Lived States in NMR

Author(s): A. Sonnefeld, A. Razanahoera, P. Pelupessy, G. Bodenhausen, and K. Sheberstov
Published in: Science Advances, 2022, ISSN 2375-2548
Publisher: American Association for the Advancement of Science
DOI: 10.1126/sciadv.ade2113

Selective Peptide Binders to the Perfluorinated Sulfonic Acid Ionomer Nafion

Author(s): Dimitry Schmidt, Patrizia Gartner, Ivan Berezkin, Jens Rudat, Maximilian Bilger, Tom Grünert, Nadine Zimmerer, Philipp Quarz, Philip Scharfer, Julian Brückel, André P. Jung, Pooja Singh, Pooja Pooja, Benno Meier, Mareen Stahlberger, Wilhelm Schabel, Stefan Bräse, Gisela Lanza, and Alexander Nesterov-Mueller
Published in: Advanced Functional Materials, 2023, ISSN 1616-301X
Publisher: John Wiley & Sons Ltd.
DOI: 10.1002/adfm.202214932

Radical-Induced Low-Field 1H Relaxation in Solid Pyruvic Acid Doped with Trityl-OX063

Author(s): M. Jurkutat, H. Kouřilová, D. Peat, K. Kouřil, A. S. Khan, A. J. Horsewill, J. F. MacDonald, J. Owers-Bradley, and B. Meier
Published in: The Journal of Physical Chemistry Letters, 2022, ISSN 1948-7185
Publisher: American Chemical Society
DOI: 10.1021/acs.jpclett.2c02357

Deep regression with ensembles enables fast, first-order shimming in low-field NMR

Author(s): Moritz Becker, Mazin Jouda, Anastasiya Kolchinskaya, and Jan Korvink
Published in: J. Magn. Reson, 2022, ISSN 1090-7807
Publisher: Academic Press
DOI: 10.1016/j.jmr.2022.107151

Polychromatic Excitation of Delocalized Long-Lived Proton Spin States in Aliphatic Chains

Author(s): A. Sonnefeld, G. Bodenhausen, and K. Sheberstov
Published in: Phys. Rev. Letters, Issue 129, 2022, ISSN 0031-9007
Publisher: American Physical Society
DOI: 10.1103/physrevlett.129.183203

Radical-induced hetero-nuclear mixing and low-field 13C relaxation in solid pyruvic acid

Author(s): H. Kouřilová, M. Jurkutat, D. Peat, K. Kouřil, A. S. Khan, A. J. Horsewill, J. F. MacDonald, J. Owers-Bradley, and B. Meier
Published in: Physical Chemistry Chemical Physics, 2022, ISSN 1463-9084
Publisher: Royal society of chemistry
DOI: 10.1039/d2cp04535d

Sample-centred shimming enables independent parallel NMR detection

Author(s): Yen-Tse Cheng, Mazin Youda, and Jan Korvink
Published in: Scientific Reports, 2022, ISSN 2045-2322
Publisher: Nature Publishing Group
DOI: 10.1038/s41598-022-17694-y

A cryogen-free, semi-automated apparatus for bullet-dynamic nuclear polarization with improved resolution

Author(s): K. Kouřil, M. Gramberg, M. Jurkutat, H. Kouřilová, and B. Meier
Published in: Magnetic Resonance, 2021, ISSN 2699-0016
Publisher: Göttingen: Copernicus Publications
DOI: 10.5194/mr-2-815-2021

Lenz Lenses in a Cryoprobe: Boosting NMR Sensitivity Toward Environmental Monitoring of Mass-Limited Samples

Author(s): Monica Bastawrous, Rajshree Ghosh Biswas, Ronald Soong, Mazin Jouda, Neil MacKinnon, Dario Mage, Jan G. Korvink, and Andre J. Simpson
Published in: Anal. Chem, 2023, ISSN 0003-2700
Publisher: American Chemical Society
DOI: 10.1021/acs.analchem.2c04203

Acquisitions with random shim values enhance AI-driven NMR shimming

Author(s): Moritz Becker, Sören Lehmkuhl, Stefan Kesselheim, Jan G. Korvink, andMazin Jouda
Published in: J. Magn. Reson, 2022, ISSN 1090-7807
Publisher: Academic Press
DOI: 10.1016/j.jmr.2022.107323

Paramagnetic Relaxivity of Delocalised Long-Lived States of Protons in Chains of CH2 Groups

Author(s): A. Razanahoera, A. Sonnefeld, G. Bodenhausen, and K. Sheberstov
Published in: Magnetic Resonance, 2023, ISSN 2699-0016
Publisher: Göttingen: Copernicus Publications
DOI: 10.5194/mr-4-47-2023