Big data and simulations in NMR crystallography: general discussion
Lee Brammer opened the discussion of the introductory Spiers Memorial Lecture by Lyndon Emsley: Your presentation (https://doi.org/10.1039/d4fd00151f) has focused on 1H and 13C spectroscopic measurements as these are the prominent NMR-active nuclei in the systems you discussed. In systems with
Authors
- Sarah L. Price (ORCID: https://orcid.org/0000-0002-1230-7427)
- Michael A. Hope (ORCID: https://orcid.org/0000-0002-4742-9336)
- Sharon E. Ashbrook (ORCID: https://orcid.org/0000-0002-4538-6782)
- Colan E. Hughes (ORCID: https://orcid.org/0000-0003-2374-2763)
- Thibault Charpentier (ORCID: https://orcid.org/0000-0002-3034-1389)
- Frédéric Blanc (ORCID: https://orcid.org/0000-0001-9171-1454)
- Martin Dračínský (ORCID: https://orcid.org/0000-0002-4495-0070)
- S. Kocher (ORCID: https://orcid.org/0000-0001-9501-1703)
- Lyndon Emsley (ORCID: https://orcid.org/0000-0003-1360-2572)
- Paul Hodgkinson (ORCID: https://orcid.org/0000-0003-0327-3349)
- Benjamin J. Rhodes (ORCID: https://orcid.org/0000-0002-6133-6531)
- Gregory J. O. Beran (ORCID: https://orcid.org/0000-0002-2229-2580)
- Lee Brammer (ORCID: https://orcid.org/0000-0001-6435-7197)
- Jan Blahut (ORCID: https://orcid.org/0000-0001-7752-8370)
- Kenneth D. M. Harris (ORCID: https://orcid.org/0000-0001-7855-8598)
- Leonard J. Mueller (ORCID: https://orcid.org/0000-0002-2607-9875)
- Sten O. Nilsson Lill (ORCID: https://orcid.org/0000-0003-4818-8084)
- Steven P. Brown (ORCID: https://orcid.org/0000-0003-2069-8496)
- Marta K. Dudek (ORCID: https://orcid.org/0000-0003-3412-0177)
- Daria Torodii (ORCID: https://orcid.org/0000-0002-5436-9503)
- Andrew J. Morris (ORCID: https://orcid.org/0000-0001-7453-5698)
- Angela F. Harper (ORCID: https://orcid.org/0000-0002-0699-0450)
- Andrew L. Goodwin (ORCID: https://orcid.org/0000-0001-9231-3749)
- Carlos Bornes
- Carl H. Fleischer
Publication Details
- Journal
- Faraday Discussions
- Published
- 2024-12-06
- DOI
- https://doi.org/10.1039/d4fd90054e
- Primary Topic
- NMR spectroscopy and applications
- Type
- article
- Field-Weighted Citation Impact
- 0.00