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Peer-reviewedLicence not statedJournal of Chemical Information and Modeling

NMR-Challenge for LLMs: Evaluating Chemical Reasoning in Humans and AI

  • Samiha Sharlin1,2
  • Fariha Agbere1,2
  • Kevin Ishimwe3,2
  • Zuzana Osifová4,5,6,7
  • Ondřej Socha4,6
  • Martin Dračínský4,6
  • Tyler R. Josephson1,3,2
7 affiliations
  1. 1Department of Chemical, Biochemical & Environmental Engineering, University of Maryland Baltimore County, 1000 Hilltop Circle, Baltimore, Maryland 21250, United States
  2. 2University of Maryland, Baltimore County
  3. 3Department of Computer Science & Electrical Engineering, University of Maryland Baltimore County, 1000 Hilltop Circle, Baltimore, Maryland 21250, United States
  4. 4Czech Academy of Sciences
  5. 5Department of Chemical and Biological Physics
  6. 6Institute of Organic Chemistry and Biochemistry
  7. 7Weizmann Institute of Science
Open at sourceDOICite

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Cite

BibTeXRIS
BibTeX
@article{sharlin2026nmrchallenge,
  title = {{NMR-Challenge for LLMs: Evaluating Chemical Reasoning in Humans and AI}},
  author = {Samiha Sharlin and Fariha Agbere and Kevin Ishimwe and Zuzana Osifová and Ondřej Socha and Martin Dračínský and Tyler R. Josephson},
  journal = {Journal of Chemical Information and Modeling},
  year = {2026},
  month = may,
  doi = {10.1021/acs.jcim.6c00481},
  url = {https://doi.org/10.26434/chemrxiv-2025-x8h36},
}
RIS
TY  - JOUR
TI  - NMR-Challenge for LLMs: Evaluating Chemical Reasoning in Humans and AI
AU  - Samiha Sharlin
AU  - Fariha Agbere
AU  - Kevin Ishimwe
AU  - Zuzana Osifová
AU  - Ondřej Socha
AU  - Martin Dračínský
AU  - Tyler R. Josephson
PY  - 2026
DA  - 2026/05/21
JO  - Journal of Chemical Information and Modeling
DO  - 10.1021/acs.jcim.6c00481
UR  - https://doi.org/10.26434/chemrxiv-2025-x8h36
SN  - 1549-9596
SN  - 1549-960X
ER  -