| 1 |
Carbohydrate-Aromatic Interactions: Vibrational Spectroscopy and Structural Assignment of Isolated Monosaccharide Complexes with p-Hydroxy Toluene and N-Acetyl L-Tyrosine Methylamide
Stanca-Kaposta EC, Carcabal P, Cocinero EJ, Hurtado P, Simons JP
Journal of Physical Chemistry B, 117(27), 8135, 2013 |
| 2 |
'Naked' and Hydrated Conformers of the Conserved Core Pentasaccharide of N-linked Glycoproteins and Its Building Blocks
Barry CS, Cocinero EJ, Carcabal P, Gamblin DP, Stanca-Kaposta EC, Remmert SM, Fernandez-Alonso MC, Rudic S, Simons JP, Davis BG
Journal of the American Chemical Society, 135(45), 16895, 2013 |
| 3 |
Monosaccharide-Water Complexes: Vibrational Spectroscopy and Anharmonic Potentials
Jin L, Simons JP, Gerber RB
Journal of Physical Chemistry A, 116(46), 11088, 2012 |
| 4 |
Computational Studies of Protonated beta-D-Galactose and Its Hydrated Complex: Structures, Interactions, Proton Transfer Dynamics, and Spectroscopy
Xie HB, Jin L, Rudic S, Simons JP, Gerber RB
Journal of Physical Chemistry B, 116(16), 4851, 2012 |
| 5 |
Structures of the xylose-water complex: Energetics, transitions between conformers and spectroscopy
Jin L, Simons JP, Gerber RB
Chemical Physics Letters, 518, 49, 2011 |
| 6 |
Vibrational Spectra of alpha-Glucose, beta-Glucose, and Sucrose: Anharmonic Calculations and Experiment
Brauer B, Pincu M, Buch V, Bar I, Simons JP, Gerber RB
Journal of Physical Chemistry A, 115(23), 5859, 2011 |
| 7 |
Isotopic Hydration of Cellobiose: Vibrational Spectroscopy and Dynamical Simulations
Pincu M, Cocinero EJ, Mayorkas N, Brauer B, Davis BG, Gerber RB, Simons JP
Journal of Physical Chemistry A, 115(34), 9498, 2011 |
| 8 |
Sensing the anomeric effect in a solvent-free environment
Cocinero EJ, Carcabal P, Vaden TD, Simons JP, Davis BG
Nature, 469(7328), 76, 2011 |
| 9 |
Carbohydrate-aromatic interactions: A computational and IR spectroscopic investigation of the complex, methyl alpha-L-fucopyranoside center dot toluene, isolated in the gas phase
Su Z, Cocinero EJ, Stanca-Kaposta EC, Davis BG, Simons JP
Chemical Physics Letters, 471(1-3), 17, 2009 |
| 10 |
The intrinsic conformation of a Lewis antigen: The Lewis x trisaccharide
Su Z, Wagner B, Cocinero EJ, Ernst B, Simons JP
Chemical Physics Letters, 477(4-6), 365, 2009 |
