Resolving Conformational Preferences of Monosaccharides from 1H and 13C NMR Chemical Shifts Using an Integrated MD and QM Approach.

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Bibliographic Details
Title: Resolving Conformational Preferences of Monosaccharides from 1H and 13C NMR Chemical Shifts Using an Integrated MD and QM Approach.
Authors: Plazinski W; Jerzy Haber Institute of Catalysis and Surface Chemistry, Polish Academy of Sciences, 30-239Krakow, Poland., Widmalm G; Department of Chemistry, Arrhenius Laboratory, Stockholm University, S-106 91Stockholm, Sweden.
Source: Journal of chemical information and modeling [J Chem Inf Model] 2026 Jul 27; Vol. 66 (14), pp. 8361-8381. Date of Electronic Publication: 2026 Jul 06.
Publication Type: Journal Article
Journal Info: Publisher: American Chemical Society Country of Publication: United States NLM ID: 101230060 Publication Model: Print-Electronic Cited Medium: Internet ISSN: 1549-960X (Electronic) Linking ISSN: 15499596 NLM ISO Abbreviation: J Chem Inf Model Subsets: MEDLINE
Database: MEDLINE Ultimate
Description
ISSN:1549-960X
DOI:10.1021/acs.jcim.6c01310