Calculation of NMR chemical shifts in carbohydrates with ONIOM: A study of the conformers of beta-D-glucopyranose

Rickard, G.A., Karadakov, P.B., Webb, G.A. and Morokuma, K. (2003) Calculation of NMR chemical shifts in carbohydrates with ONIOM: A study of the conformers of beta-D-glucopyranose. Journal of Physical Chemistry A, 107 (2). pp. 292-300. ISSN 1089-5639

Abstract

Metadata

Authors/Creators:
  • Rickard, G.A.
  • Karadakov, P.B. (pbk1@york.ac.uk)
  • Webb, G.A.
  • Morokuma, K.
Institution: The University of York
Academic Units: The University of York > Chemistry (York)
Depositing User: York RAE Import
Date Deposited: 20 Apr 2009 11:56
Last Modified: 20 Apr 2009 11:56
Published Version: http://dx.doi.org/10.1021/jp027279l
Status: Published
Publisher: American Chemical Society
Identification Number: 10.1021/jp027279l

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