A Hydration Study of (1→4) and (1→6) Linked α-Glucans by Comparative 10 ns Molecular Dynamics Simulations and 500-MHz NMR

The hydration behavior of two model disaccharides, methyl-α-D-maltoside (1) and methyl-α-D-isomaltoside (2), has been investigated by a comparative 10 ns molecular dynamics study. The detailed hydration of the two disaccharides was described using three force fields especially developed for modeling...

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Main Authors: CORZANA, FRANCISCO, MOTAWIA, MOHAMMED S., DU PENHOAT, CATHERINE HERVÉ, PEREZ, SERGE, TSCHAMPEL, SARAH M., WOODS, ROBERT J., ENGELSEN, SØREN B.
Format: Artigo
Language:Inglês
Published: 2004
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Article
Online Access:https://ncbi.nlm.nih.gov/pmc/articles/PMC4201036/
https://ncbi.nlm.nih.gov/pubmed/14735575
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1002/jcc.10405
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