All living systems are comprised of four fundamental classes of macromolecules–nucleic
acids, proteins, lipids, and carbohydrates (glycans). Glycans play a unique role of joining …

Nuclear magnetic resonance (NMR) is widely used across many fields of science because
of the rich data it produces, and some of the most valuable data come from studies of …

Conformational sampling for a set of 10 α-or β-(1→ 6)-linked oligosaccharides has been
studied using explicit solvent Hamiltonian replica exchange (HREX) simulations and NMR …

The intrinsic flexibility of carbohydrates facilitates different 3D structures in response to
altered environments. At glycosidic (1→ 6)-linkages, three torsion angles are variable, and …

In this work, we develop a self-consistent route to inspect the conformational mobility of
single chains in gold nanoparticles passivated with a monolayer of decanethiols. The …

METHODS The ultimate goal of the TOFEE strategy is to impart phase modulations given by
an N× N Fourier matrix on a set of {fn} n= 1,…, N resonance lines of a priori known positions …

Abstract Cyanovirin-N (CV-N) is a cyanobacterial lectin with antiviral activity towards HIV
and several other viruses. Here, we identify mannoside hydroxyl protons that are hydrogen …

The monosaccharide L-rhamnose is common in bacterial polysaccharides and the
disaccharide α-L-Rhap-α-(1→ 2)-α-L-Rhap-OMe represents a structural model for a part of …

Empirical force fields for computer simulations of carbohydrates are often implicitly assumed
to be valid also at temperatures different from room temperature for which they were …

The solution geometries of D-Glcp, Me-D-Glcp, 6-O-Me-D-Glcp, Me-6-O-Me-D-Glcp, D-Glcp-
(α-1, 6)-D-Glcp (isomaltose), D-Glcp-(α-1, 6)-D-Glcp-(α-1, 6)-D-Glcp (isomaltotriose), D-Galp …