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BioMed Research International
Volume 2014, Article ID 808071, 11 pages
http://dx.doi.org/10.1155/2014/808071
Research Article

Glycosaminoglycan Monosaccharide Blocks Analysis by Quantum Mechanics, Molecular Dynamics, and Nuclear Magnetic Resonance

1Structural Bioinformatics, BIOTEC, TU Dresden, Tatzberg 47-51, 01307 Dresden, Germany
2Institute of Medical Physics and Biophysics, University of Leipzig, Härtelstr. 16-18, 04107 Leipzig, Germany

Received 17 December 2013; Accepted 22 January 2014; Published 7 April 2014

Academic Editor: Dieter Scharnweber

Copyright © 2014 Sergey A. Samsonov et al. This is an open access article distributed under the Creative Commons Attribution License, which permits unrestricted use, distribution, and reproduction in any medium, provided the original work is properly cited.

Supplementary Material

Supplementary Tables 1–12: The description should be "Chemical shifts calculated by GIAO approach".

Supplementary Tables 13–17: The description should be "Chemical shifts calculated by GIAO approach".

Supplementary Tables 13–16: The description should be "3JH-H calculated by GIAO approach".

Supplementary Table 18: The description should be "3JH-H calculated by GIAO approach".

Supplementary Table 19: 1H chemical shifts in CH3 of the acetyl group of Glc/GalNAc derivatives for gg/gt/tg conformations.

Supplementary Table 18: 1H chemical shifts in CH3 of the acetyl group of Glc/GalNAc derivatives.

Supplementary Table 19: 1H chemical shifts in CH3 of the acetyl group of Glc/GalNAc derivatives for gg/gt/tg conformations.

  1. Supplementary Material