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The array of GXM oligosaccharides simulated in this work, shown with the SNFG symbols [13,14] for the sugar residues. Six RUs of an unsubstituted backbone (cnX); the main repeat motifs in serogroup D (cnD) serogroup A (cnA) and 6-O-acetylated serogroup A (cnA’) were run in separate simulations; and three shorter strands of serogroup A GXM: a decasaccharide (cnAdec), a 6-O-acetylated decasaccharide (cnAdec’) and a tetrasaccharide (cnAtet).
