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Hydration of the sulfate dianion in size-selected water clusters: From SO42−(H2O)9 to SO42−(H2O)13
Florian Thaunay
,
Ayah A Hassan
,
Richard J Cooper
,
Evan R Williams
,
Carine Clavaguera
,
et al.
Article dans une revue
hal-01999955v1
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Probing the mechanisms and dynamics of gas phase hydrogen–deuterium exchange reactions of sodiated polyglycines
T. Mcmahon
,
G. Ohanessian
Article dans une revue
hal-02001037v1
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Strategy for Modeling the Infrared Spectra of Ion-Containing Water Drops
Florian Thaunay
,
Chandramohan Jana
,
Carine Clavaguéra
,
Gilles Ohanessian
Article dans une revue
hal-02161555v1
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Free energy simulations of a GTPase: GTP and GDP binding to archaeal initiation factor 2.
Priyadarshi Satpati
,
Carine Clavaguera
,
Gilles Ohanessian
,
Thomas Simonson
Article dans une revue
hal-00764855v1
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Structure of sodiated octa-glycine: IRMPD spectroscopy and molecular modeling.
David Semrouni
,
O Petru Balaj
,
Florent Calvo
,
Catarina F Correia
,
Carine Clavaguéra
,
et al.
Article dans une revue
istex
hal-00528518v1
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A quantitative basis for a scale of Na+ affinities of organic and small biological molecules in the gas phase.
S. Hoyau
,
K. Norrman
,
T. B. Mcmahon
,
Gilles Ohanessian
Article dans une revue
istex
hal-00462577v1
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The Na+ affinities of alpha-amino acids: side-chain substituent effects
M. Kish
,
Gilles Ohanessian
,
C. Wesdemiotis
Article dans une revue
istex
hal-00917383v1
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Infrared Spectra of Deprotonated Dicarboxylic Acids: IRMPD Spectroscopy and Empirical Valence‐Bond Modeling
Florian Thaunay
,
Florent Calvo
,
Edith Nicol
,
Gilles Ohanessian
,
Carine Clavaguéra
Article dans une revue
hal-02161622v1
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A comparative study of semiempirical, ab initio, and DFT methods in evaluating metal-ligand bond strength, proton affinity, and interactions between first and second shell ligands in Zn-biomimetic complexes
Gilles Frison
,
Gilles Ohanessian
Article dans une revue
hal-00466475v1
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Interaction of neutral and zwitterionic glycine with Zn2+ in gas phase: ab initio and SIBFA molecular mechanics calculations
Françoise Rogalewicz
,
Gilles Ohanessian
,
Nohad Gresh
Article dans une revue
hal-00904630v1
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Vibrational Signature Of Charge Solvation Vs Salt Bridge Isomers Of Sodiated Amino Acids In The Gas Phase
C. Kapota
,
J. Lemaire
,
P. Maitre
,
Gilles Ohanessian
Journal of the American Chemical Society, 2004, 126 (6), pp.1836-1842
Article dans une revue
hal-00462612v1
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Metal–acetylene binding in gaseous WC2H2+
Christelle Gée
,
Pierre Boissel
,
Gilles Ohanessian
Article dans une revue
istex
hal-01826513v1
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Cu(II)-catalyzed reactions in ternary [Cu(AA)(AA - H)]+ complexes (AA = Gly, Ala, Val, Leu, Ile, t-Leu, Phe).
Ping Wang
,
Gilles Ohanessian
,
Chrys Wesdemiotis
Article dans une revue
hal-00528515v1
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Vibrational spectroscopy of deprotonated peptides containing an acidic side chain
Edith Nicol
,
Carine Clavaguéra
,
Gilles Ohanessian
Article dans une revue
hal-02161605v1
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The sodium ion affinities of asparagine, glutamine, histidine and arginine
Ping Wang
,
Gilles Ohanessian
,
Chrys Wesdemiotis
Article dans une revue
istex
hal-00528512v1
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Alkali metal ion binding to amino acids versus their methyl esters: affinity trends and structural changes in the gas phase.
J.M. Talley
,
B.A. Cerda
,
Gilles Ohanessian
,
C. Wesdemiotis
Article dans une revue
istex
hal-00918086v1
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Finite Temperature Infrared Spectra from Polarizable Molecular Dynamics Simulations
David Semrouni
,
Ashwani Sharma
,
Jean-Pierre Dognon
,
Gilles Ohanessian
,
Carine Clavaguéra
Article dans une revue
hal-01157638v1
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Comparison between alpha- and beta-carbonic anhydrases: can Zn(His)3(H2O) and Zn(His)(Cys)2(H2O) sites lead to equivalent enzymes?
Florent Pannetier
,
Gilles Ohanessian
,
Gilles Frison
Article dans une revue
hal-00555426v1
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Metal-histidine-glutamate as a regulator of enzymatic cycles: a case study of carbonic anhydrase.
Gilles Frison
,
Gilles Ohanessian
Article dans une revue
hal-00467064v1
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Complexation of glycine by atomic metal cations in the gas phase
Sophie Hoyau
,
Jean-Pierre Pélicier
,
Yannick Hoppilliard
,
Françoise Rogalewicz
,
Gilles Ohanessian
Article dans une revue
hal-00918616v1
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Structural characterization by IRMPD spectroscopy and DFT calculations of deprotonated phosphorylated amino acids in the gas phase.
D. Scuderi
,
C. F. Correia
,
O. P. Balaj
,
Gilles Ohanessian
,
Joël Lemaire
,
et al.
Article dans une revue
hal-00528516v1
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Assessment of density functionals for predicting the infrared spectrum of sodiated octa-glycine.
David Semrouni
,
Carine Clavaguéra
,
Jean-Pierre Dognon
,
Gilles Ohanessian
Article dans une revue
istex
hal-00904592v1
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Structures and fragmentations of electrosprayed Zn(II) complexes of carboxylic acids in the gas phase: Isomerisation versus desolvation during the last desolvation step
Françoise Rogalewicz
,
Gilles Louazel
,
Yannick Hoppilliard
,
Gilles Ohanessian
Article dans une revue
istex
hal-00917380v1
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The alkylation mechanism of zinc-bound thiolates depends upon the zinc ligands.
Delphine Picot
,
Gilles Ohanessian
,
Gilles Frison
Article dans une revue
istex
hal-00467062v1
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Electrolytic electrospray ionization mass spectrometry of quaterthiophene-bridged bisporphyrins: beyond the identification tool.
D. Rondeau
,
Françoise Rogalewicz
,
Gilles Ohanessian
,
E. Levillain
,
F. Odobel
,
et al.
Article dans une revue
istex
hal-00015742v1
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Structure of sodiated polyglycines.
O. Petru Balaj
,
David Semrouni
,
Vincent Steinmetz
,
Edith Nicol
,
Carine Clavaguera
,
et al.
Article dans une revue
istex
hal-00904385v1
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The sodium ion affinity of glycylglycine
M.M. Kish
,
C. Wesdemiotis
,
Gilles Ohanessian
Article dans une revue
istex
hal-00917366v1
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Structures and fragmentations of zinc(II) complexes of amino acids in the gas phase IV. Solvent effect on the structure of electrosprayed ions
Françoise Rogalewicz
,
Yannick Hoppilliard
,
Gilles Ohanessian
Article dans une revue
istex
hal-00917381v1
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Fragmentation mechanisms of alpha-amino acids protonated under electrospray ionization: A collisional activation and ab initio theoretical study
Françoise Rogalewicz
,
Yannick Hoppilliard
,
Gilles Ohanessian
Article dans une revue
istex
hal-00922247v1
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When Does Electronic Delocalizatlon Become a Driving Force of Chemical Bonding?
S.S. Shaik
,
P. C. Hiberty
,
G. Ohanessian
,
J.-M. Lefour
Article dans une revue
istex
hal-00463443v1
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