Vibrational Spectra of α-Glucose, β-Glucose, and Sucrose: Anharmonic Calculations and Experiment
Brauer, Brina, Pincu, Madeleine, Buch, Victoria, Bar, Ilana, Simons, John. P, Gerber, R. Benny
Published in The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory (16.06.2011)
Published in The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory (16.06.2011)
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Journal Article
Sensing the anomeric effect in a solvent-free environment
Cocinero, Emilio J., Carcabal, Pierre, Vaden, Timothy D., Simons, John P., Davis, Benjamin G.
Published in Nature (London) (06.01.2011)
Published in Nature (London) (06.01.2011)
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Journal Article
IR-Spectral Signatures of Aromatic-Sugar Complexes: Probing Carbohydrate-Protein Interactions
Screen, James, Stanca-Kaposta, E. Cristina, Gamblin, David P., Liu, Bo, Macleod, Neil A., Snoek, Lavina C., Davis, Benjamin G., Simons, John P.
Published in Angewandte Chemie International Edition (01.01.2007)
Published in Angewandte Chemie International Edition (01.01.2007)
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Journal Article
Hydration of Sugars in the Gas Phase: Regioselectivity and Conformational Choice in N-Acetyl Glucosamine and Glucose
Cocinero, Emilio J., Stanca-Kaposta, E. Cristina, Dethlefsen, Mark, Liu, Bo, Gamblin, David P., Davis, Benjamin G., Simons, John P.
Published in Chemistry : a European journal (14.12.2009)
Published in Chemistry : a European journal (14.12.2009)
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Journal Article
Heavy water hydration of mannose: the anomeric effect in solvation, laid bare
Mayorkas, Nitzan, Rudić, Svemir, Davis, Benjamin G., Simons, John P.
Published in Chemical science (Cambridge) (01.01.2011)
Published in Chemical science (Cambridge) (01.01.2011)
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Journal Article
Carbohydrate molecular recognition: a spectroscopic investigation of carbohydrate-aromatic interactions
Stanca-Kaposta, E Cristina, Gamblin, David P, Screen, James, Liu, Bo, Snoek, Lavina C, Davis, Benjamin G, Simons, John P
Published in Physical chemistry chemical physics : PCCP (28.08.2007)
Published in Physical chemistry chemical physics : PCCP (28.08.2007)
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Journal Article
Vibrational Spectroscopy and Conformational Structure of Protonated Polyalanine Peptides Isolated in the Gas Phase
Vaden, Timothy D, de Boer, Tjalling S. J. A, Simons, John P, Snoek, Lavina C, Suhai, Sándor, Paizs, Béla
Published in The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory (22.05.2008)
Published in The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory (22.05.2008)
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Journal Article
Isotopic Hydration of Cellobiose: Vibrational Spectroscopy and Dynamical Simulations
Pincu, Madeleine, Cocinero, Emilio J, Mayorkas, Nitzan, Brauer, Brina, Davis, Benjamin G, Gerber, R. Benny, Simons, John P
Published in The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory (01.09.2011)
Published in The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory (01.09.2011)
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Journal Article
Conformational Choice and Selectivity in Singly and Multiply Hydrated Monosaccharides in the Gas Phase
Cocinero, Emilio J., Stanca-Kaposta, E. Cristina, Scanlan, Eoin M., Gamblin, David P., Davis, Benjamin G., Simons, John P.
Published in Chemistry : a European journal (10.10.2008)
Published in Chemistry : a European journal (10.10.2008)
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Journal Article
Alanyl Side Chain Folding in Phenylalanine: Conformational Assignments through Ultraviolet Rotational Band Contour Analysis
Lee, Yonghoon, Jung, Jiwon, Kim, Bongsoo, Butz, Patrick, Snoek, Lavina C, Kroemer, Romano T, Simons, John P
Published in The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory (08.01.2004)
Published in The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory (08.01.2004)
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Journal Article
Hydrated complexes of tryptophan: ion dip infrared spectroscopy in the 'molecular fingerprint' region, 100-2000 cm-1
CARCABAL, Pierre, KROEMER, Romano T, SNOEK, Lavina C, SIMONS, John P, BAKKER, Joost M, COMPAGNON, Isabelle, MEIJER, Gerard, VON HELDEN, Gert
Published in Physical chemistry chemical physics : PCCP (01.01.2004)
Published in Physical chemistry chemical physics : PCCP (01.01.2004)
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Journal Article
Neurotransmitters in the gas phase: Infrared spectroscopy and structure of protonated ethanolamine
MACLEOD, Neil A, SIMONS, John P
Published in Physical chemistry chemical physics : PCCP (21.05.2004)
Published in Physical chemistry chemical physics : PCCP (21.05.2004)
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Journal Article
Structure, electronic circular dichroism and Raman optical activity in the gas phase and in solution: a computational and experimental investigation
Macleod, Neil A, Butz, Patrick, Simons, John P, Grant, Guy H, Baker, Christopher M, Tranter, George E
Published in Physical chemistry chemical physics : PCCP (07.04.2005)
Published in Physical chemistry chemical physics : PCCP (07.04.2005)
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Journal Article
The Building Blocks of Cellulose: The Intrinsic Conformational Structures of Cellobiose, Its Epimer, Lactose, and Their Singly Hydrated Complexes
Cocinero, Emilio J, Gamblin, David P, Davis, Benjamin G, Simons, John P
Published in Journal of the American Chemical Society (12.08.2009)
Published in Journal of the American Chemical Society (12.08.2009)
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Journal Article
Conformational Preferences of Neurotransmitters: Ephedrine and Its Diastereoisomer, Pseudoephedrine
Butz, Patrick, Kroemer, Romano T, Macleod, Neil A, Simons, John P
Published in The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory (25.01.2001)
Published in The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory (25.01.2001)
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Journal Article
Neurotransmitters in the gas phase: hydrated noradrenaline
SNOEK, Lavina C, VAN MOURIK, Tanja, CARGABAL, Pierre, SIMONS, John P
Published in Physical chemistry chemical physics : PCCP (01.01.2003)
Published in Physical chemistry chemical physics : PCCP (01.01.2003)
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Journal Article
Binding energies of micro-hydrated carbohydrates: measurements and interpretation
Çarçabal, Pierre, Cocinero, Emilio J, Simons, John P
Published in Chemical science (Cambridge) (04.03.2013)
Published in Chemical science (Cambridge) (04.03.2013)
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Journal Article