CV Anne Zehnacker

Ariel Pérez-Mellor, Ivan Alata, Valeria Lepere, Riccardo Spezia, Anne Zehnacker-Rentien. Stereospecific Collision-Induced Dissociation and Vibrational Spectroscopy of Protonated Cyclo (Tyr-Pro). International Journal of Mass Spectrometry, Elsevier, 2021, 465, pp.116590. ⟨10.1016/j.ijms.2021.116590⟩. ⟨hal-03195968⟩

Ariel Pérez-Mellor, Katia Le Barbu-Debus, Valeria Lepere, Ivan Alata, Riccardo Spezia, et al.. Structure and Collision-Induced Dissociation of the protonated cyclo His-Phe Dipeptide: Mechanistic Studies and Stereochemical Effects. The European Physical Journal D : Atomic, molecular, optical and plasma physics, EDP Sciences, 2021, 75 (6), ⟨10.1140/epjd/s10053-021-00173-w⟩. ⟨hal-03249830⟩

Katia Le Barbu-Debus, Anne Zehnacker. Competition between inter and intramolecular hydrogen bond evidenced by vibrational circular dichroism spectroscopy: The case of (1S,2R)‐(−)‐cis‐1‐amino‐2‐indanol. Chirality, Wiley, 2021, ⟨10.1002/chir.23362⟩. ⟨hal-03356734⟩

Venkateswara Rao Mundlapati, Zeynab Imani, Gildas Goldsztejn, Eric Gloaguen, Valérie Brenner, et al.. A theoretical and experimental case study of the hydrogen bonding predilection of S-methylcysteine. Amino Acids, Springer Verlag, 2021, 53 (4), pp.621-633. ⟨10.1007/s00726-021-02967-z⟩. ⟨hal-03186714⟩

Sascha Jähnigen, Anne Zehnacker, Rodolphe Vuilleumier. Computation of Solid-State Vibrational Circular Dichroism in the Periodic Gauge. Journal of Physical Chemistry Letters, American Chemical Society, 2021, pp.7213-7220. ⟨10.1021/acs.jpclett.1c01682⟩. ⟨hal-03311633⟩

Katia Le Barbu-Debus, Jessica Bowles, Sascha Jähnigen, Carine Clavaguéra, Florent Calvo, et al.. Assessing cluster models of solvation for the description of vibrational circular dichroism spectra: synergy between static and dynamic approaches. Physical Chemistry Chemical Physics, Royal Society of Chemistry, 2020, ⟨10.1039/D0CP03869E⟩. ⟨hal-03008629⟩

Ariel Pérez‐mellor, Katia Le Barbu-Debus, Anne Zehnacker. Solid‐state synthesis of cyclo LD‐diphenylalanine: A chiral phase built from achiral subunits. Chirality, Wiley, 2020, 32 (5), pp.693-703. ⟨10.1002/chir.23195⟩. ⟨hal-02571724⟩

Xue Li, Marianna Porcino, Charlotte Martineau-Corcos, Tao Guo, Ting Xiong, et al.. Efficient incorporation and protection of lansoprazole in cyclodextrin metal-organic frameworks. International Journal of Pharmaceutics, Elsevier, 2020, 585, ⟨10.1016/j.ijpharm.2020.119442⟩. ⟨hal-02844079⟩

Marianna Porcino, Charlotte Martineau-Corcos, Weifeng Zhu, Gilles Patriarche, Christine Péchoux, et al.. Glycoside scutellarin enhanced CD-MOF anchoring for laryngeal delivery. Acta Pharmaceutica Sinica B, Elsevier, 2020, 10 (9), pp.1709-1718. ⟨10.1016/j.apsb.2020.04.015⟩. ⟨hal-03095979⟩

Katia Le Barbu-Debus, Jessica Bowles, Sascha Jähnigen, Carine Clavaguéra, Florent Calvo, et al.. Assessing Cluster Models of Solvation for the Description of Vibrational Circular Dichroism Spectra: Synergy between Static and Dynamic Approaches. Physical Chemistry Chemical Physics, Royal Society of Chemistry, 2020, 22 (45), pp.26047-26068. ⟨10.1039/D0CP03869E⟩. ⟨hal-03014777⟩

Zeynab Imani, Venkateswara Rao Mundlapati, Gildas Goldsztejn, Valerie Brenner, Eric Gloaguen, et al.. Conformation control through concurrent N–H⋯S and N–H⋯O=C hydrogen bonding and hyperconjugation effects. Chemical Science , The Royal Society of Chemistry, 2020, 11, pp.9191-9197. ⟨10.1039/D0SC03339A⟩. ⟨hal-02917912⟩

Beppo Hartwig, Manuel Lange, Anja Poblotzki, Robert Medel, Anne Zehnacker, et al.. The reduced cohesion of homoconfigurational 1,2-diols. Physical Chemistry Chemical Physics, Royal Society of Chemistry, 2020, 22 (3), pp.1122-1136. ⟨10.1039/c9cp04943f⟩. ⟨hal-02473832⟩

Katia Le Barbu-Debus, Debora Scuderi, Valéria Lepère, Anne Zehnacker. Homochiral vs. heterochiral sodium core dimers of tartaric acid esters: A mass spectrometry and vibrational spectroscopy study. Journal of Molecular Structure, Elsevier, 2020, 1205, pp.127583. ⟨10.1016/j.molstruc.2019.127583⟩. ⟨hal-02441869⟩

Keisuke Hirata, yuta Mori, Shun-Ichi Ishiuchi, Masaaki Fujii, Anne Zehnacker. Chiral discrimination between tyrosine and -cyclodextrin revealed by cryogenic ion trap infrared spectroscopy. Physical Chemistry Chemical Physics, Royal Society of Chemistry, 2020, ⟨10.1039/d0cp02968h⟩. ⟨hal-02993740⟩

Feriel Ben Nasr, Ivan Alata, Debora Scuderi, Valéria Lepère, Valérie Brenner, et al.. Effects of complexation with sulfuric acid on the photodissociation of protonated Cinchona alkaloids in the gas phase. Physical Chemistry Chemical Physics, Royal Society of Chemistry, 2019, 21 (28), pp.15439-15451. ⟨10.1039/c9cp01518c⟩. ⟨hal-02347956⟩

Masato Tamura, Tsubasa Sekiguchi, Shun-Ichi Ishiuchi, Anne Zehnacker-Rentien, Masaaki Fujii. Can the Partial Peptide SIVSF of β 2 -Adrenergic Receptor Recognize Chirality of Epinephrine Neurotransmitter?. Journal of Physical Chemistry Letters, American Chemical Society, 2019, ⟨10.1021/acs.jpclett.9b00184⟩. ⟨hal-02070253⟩

Ariel Pérez-Mellor, Ivan Alata, Valéria Lepère, Anne Zehnacker. Conformational Study of the Jet-Cooled Diketopiperazine Peptide Cyclo Tyrosyl-Prolyl. Journal of Physical Chemistry B, American Chemical Society, 2019, 123 (28), pp.6023-6033. ⟨10.1021/acs.jpcb.9b04529⟩. ⟨hal-02347969⟩

Valérie Declerck, Ariel Pérez‐mellor, Régis Guillot, David Aitken, Michel Mons, et al.. Vibrational circular dichroism as a probe of solid‐state organisation of derivatives of cyclic β‐amino acids: Cis ‐ and trans ‐2‐aminocyclobutane‐1‐carboxylic acid. Chirality, Wiley, 2019, 31 (8), pp.547-560. ⟨10.1002/chir.23083⟩. ⟨hal-02347980⟩

Katia Le Barbu-Debus, Arne Scherrer, Aude Bouchet, Daniel Sebastiani, Rodolphe Vuilleumier, et al.. Effect of puckering motion and hydrogen bond formation on the vibrational circular dichroism spectrum of a flexible molecule: the case of ( S )-1-indanol. Physical Chemistry Chemical Physics, Royal Society of Chemistry, 2018, 20 (21), pp.14635-14646. ⟨10.1039/c8cp01695j⟩. ⟨hal-02070261⟩

Aude Bouchet, Johanna Klyne, Shun-Ichi Ishiuchi, Otto Dopfer, Masaaki Fujii, et al.. Stereochemistry-dependent structure of hydrogen-bonded protonated dimers: the case of 1-amino-2-indanol. Physical Chemistry Chemical Physics, Royal Society of Chemistry, 2018, 20 (18), pp.12430-12443. ⟨10.1039/c8cp00787j⟩. ⟨hal-02070263⟩

Feriel Bennasr, Ariel Pérez-Mellor, Ivan Alata, Valéria Lepère, Nejm-Eddine Jaïdane, et al.. Stereochemistry-dependent hydrogen bonds stabilise stacked conformations in jet-cooled cyclic dipeptides: (LD) vs. (LL) cyclo tyrosine–tyrosine. Faraday Discussions, Royal Society of Chemistry, 2018, 212, pp.399-419. ⟨10.1039/c8fd00079d⟩. ⟨hal-02070257⟩

Zlatko Bacic, David Benoit, Malgorzata Biczysko, Joël Bowman, Stephen Bradforth, et al.. Molecules in confinement in clusters, quantum solvents and matrices: general discussion. Faraday Discussions, Royal Society of Chemistry, 2018, 212, pp.569-601. ⟨10.1039/C8FD90053A⟩. ⟨hal-02070258⟩

Ariel Pérez-Mellor, Valéria Lepère, Anne Zehnacker, Ivan Alata. Chirality effects in the structures of jet-cooled bichromophoric dipeptides. Journal of Molecular Spectroscopy, Elsevier, 2018, 349, pp.71-84. ⟨10.1016/j.jms.2018.02.005⟩. ⟨hal-02070260⟩

Zlatko Bacic, David Benoit, Matthieu Besemer, Joël Bowman, Stephen Bradforth, et al.. Precise characterisation of isolated molecules: general discussion. Faraday Discussions, Royal Society of Chemistry, 2018, 212, pp.137-155. ⟨10.1039/C8FD90050G⟩. ⟨hal-02070254⟩

Loren Ban, Joël Bowman, Stephen Bradforth, Gilberte Chambaud, Martin Dracinsky, et al.. Molecules in confinement in liquid solvents: general discussion. Faraday Discussions, Royal Society of Chemistry, 2018, 212, pp.383-397. ⟨10.1039/C8FD90051E⟩. ⟨hal-02070256⟩

Sebastian Peukert, Michał Kijak, Jakub Ostapko, Jerzy Sepioł, Catherine Le Bris, et al.. Supersonic jet spectroscopy of parent hemiporphycene: Structural assignment and vibrational analysis for S 0 and S 1 electronic states. Journal of Chemical Physics, American Institute of Physics, 2018, 149 (13), pp.134307. ⟨10.1063/1.5048843⟩. ⟨hal-02070259⟩

Tsubasa Sekiguchi, Masato Tamura, Hikari Oba, Pierre Çarçarbal, Rolando Rafael Lozada-Garcia, et al.. Molecular Recognition by a Short Partial Peptide of the Adrenergic Receptor: A Bottom-Up Approach. Angewandte Chemie International Edition, Wiley-VCH Verlag, 2018, 57 (20), pp.5626-5629. ⟨10.1002/anie.201712976⟩. ⟨hal-02070265⟩

Dmitri Babikov, David Benoit, Joël Bowman, Timothy Burd, David Clary, et al.. Quantum dynamics of isolated molecules: general discussion. Faraday Discussions, Royal Society of Chemistry, 2018, 212, pp.281-306. ⟨10.1039/C8FD90052C⟩. ⟨hal-02070255⟩

Ariel Pérez-Mellor, Anne Zehnacker. Vibrational circular dichroism of a 2,5-diketopiperazine (DKP) peptide: Evidence for dimer formation in cyclo LL or LD diphenylalanine in the solid state. Chirality, Wiley, 2017, 29 (2), pp.89-96. ⟨10.1002/chir.22674⟩. ⟨hal-02347991⟩

Ivan Alata, Ariel Pérez-Mellor, Feriel Ben Nasr, Debora Scuderi, Vincent Steinmetz, et al.. Does the Residues Chirality Modify the Conformation of a Cyclo-Dipeptide? Vibrational Spectroscopy of Protonated Cyclo-diphenylalanine in the Gas Phase. Journal of Physical Chemistry A, American Chemical Society, 2017, 121 (38), pp.7130-7138. ⟨10.1021/acs.jpca.7b06159⟩. ⟨hal-02348003⟩

Valéria Lepère, Katia Le Barbu-Debus, Carine Clavaguera, Deborah Scuderi, Giovanni Piani, et al.. Chirality-dependent structuration of protonated or sodiated polyphenylalanines: IRMPD and ion mobility studies. Physical Chemistry Chemical Physics, Royal Society of Chemistry, 2016, 18 (3), pp.1807-18017. ⟨10.1039/c5cp06768e⟩. ⟨hal-01356198⟩

Pierre Asselin, Bruno Madebène, Pascale Soulard, Robert Georges, Manuel Goubet, et al.. Competition between inter-and intra-molecular hydrogen bonding: An infrared spectroscopic study of jet-cooled amino-ethanol and its dimer. Journal of Chemical Physics, American Institute of Physics, 2016, 145 (22), pp.224313. ⟨10.1063/1.4972016⟩. ⟨hal-01468104⟩

Sunil Kumar, Bruno Lucas, Jacqueline Fayeton, Debora Scuderi, Ivan Alata, et al.. Photofragmentation mechanisms in protonated chiral cinchona alkaloids. Physical Chemistry Chemical Physics, Royal Society of Chemistry, 2016, 18 (32), pp.22668 - 22677. ⟨10.1039/C6CP04041A⟩. ⟨hal-01385253⟩

Mohammad Alauddin, Eric Gloaguen, Valérie Brenner, Benjamin Tardivel, Michel Mons, et al.. Local folding proclivities in cyclic b -peptide building blocks: assessment of configuration and heteroatom substitution effects by gas phase conformer-selective laser spectroscopy and quantum chemistry . Chemistry - A European Journal, Wiley-VCH Verlag, 2015, 21 (46), pp.16479-16493 ⟨10.1002/chem.201501794⟩. ⟨cea-01273006⟩

R. Chaudret, B. De Courcy, J. Contreras-García, Eric Gloaguen, A. Zehnacker-Rentien, et al.. Unraveling non-covalent interactions within flexible biomolecules: from electron density topology to gas phase spectroscopy. Physical Chemistry Chemical Physics, Royal Society of Chemistry, 2014, 16, pp.9876-9891. ⟨10.1039/C3CP52774C⟩. ⟨hal-01131254⟩

Aude Bouchet, Jonas Altnöder, Michel Broquier, A. Zehnacker. IR–UV spectroscopy of jet-cooled 1-indanol: Restriction of the conformational space by hydration. Journal of Molecular Structure, Elsevier, 2014, 1076, pp.344-351. ⟨10.1016/j.molstruc.2014.07.061⟩. ⟨hal-01080713⟩

Eric Gloaguen, V. Brenner, M. Alauddin, B. Tardivel, M. Mons, et al.. Direct Spectroscopic Evidence of Hyperconjugation Unveils the Conformational Landscape of Hydrazides†. Angewandte Chemie International Edition, Wiley-VCH Verlag, 2014, 53 (50), pp.13756-13759. ⟨10.1002/anie.201407801⟩. ⟨hal-01131234⟩

A. Sen, Alexandra Bouchet, V. Lepere, Barbu-Debus K. Le, D. Scuderi, et al.. Conformational Analysis of Quinine and Its Pseudo Enantiomer Quinidine: A Combined Jet-Cooled Spectroscopy and Vibrational Circular Dichroism Study. Journal of Physical Chemistry A, American Chemical Society, 2012, 116 (32), pp.8334-8344. ⟨10.1021/jp3047888⟩. ⟨hal-00755557⟩

J. Sepioł, A. Grabowska, P. Borowicz, M. Kijak, Michel Broquier, et al.. Excited-state intramolecular proton transfer reaction modulated by low-frequency vibrations: An effect of an electron-donating substituent on the dually fluorescent bis-benzoxazole. Journal of Chemical Physics, American Institute of Physics, 2011, 135 (3), pp.034307. ⟨10.1063/1.3609759⟩. ⟨hal-00915272⟩

Debora Scuderi, Katia Le Barbu-Debus, A. Zehnacker. The role of weak hydrogen bonds in chiral recognition. Physical Chemistry Chemical Physics, Royal Society of Chemistry, 2011, 13 (40), pp.17916. ⟨10.1039/C1CP20987F⟩. ⟨hal-02305440⟩

Katia Le Barbu-Debus, Ananya Sen, Michel Broquier, Anne Zehnacker-Rentien. Jet-cooled hydrates of Chiral (S) 1,2,3,4-tetrahydro-3-isoquinoline methanol (THIQM): structure and mechanism of formation. Physical Chemistry Chemical Physics, Royal Society of Chemistry, 2011, 13, pp.13985-13991. ⟨10.1039/c1cp20939f⟩. ⟨hal-00915267⟩

K. Le Barbu-Debus, M. Broquier, A. Mahjoub, A. Zehnacker-Rentien. Chiral recognition in jet-cooled complexes of (1R,2S)-(+)-cis-1-amino-2-indanol and methyl lactate: on the importance of the CH...pi interaction.. Physical Chemistry Chemical Physics, Royal Society of Chemistry, 2009, 11 (35), pp.7589-98. ⟨hal-00915290⟩

Katia Le Barbu-Debus, Michel Broquier, Ahmed Mahjoub, Anne Zehnacker-Rentien. Chiral recognition between alpha-hydroxylesters: a double-resonance IR/UV study of the complexes of methyl mandelate with methyl glycolate and methyl lactate.. Journal of Physical Chemistry A, American Chemical Society, 2008, 112 (40), pp.9731-41. ⟨10.1021/jp711546p⟩. ⟨hal-00915259⟩

K. Le Barbu-Debus, M. Broquier, F. Lahmani, A. Zehnacker-Rentien. Localization of electronic and vibrational energy in the jet-cooled m-cyanophenol/o-cyanophenol dimer: laser induced fluorescence and fluorescence-dip IR spectra. Molecular Physics, Taylor & Francis, 2005, 103 (11-12), pp.1655-1662. ⟨hal-00915305⟩

N. Seurre, K. Le Barbu-Debus, F. Lahmani, A. Zehnacker-Rentien, Jerzy Sepioł. Electronic and vibrational spectroscopy of jet-cooled m-cyanophenol and its dimer: laser-induced fluorescence and fluorescence-dip IR spectra in the S0 and S1 states. Chemical Physics, Elsevier, 2003, 295 (1), pp.21-33. ⟨10.1016/J.CHEMPHYS.2003.07.009⟩. ⟨hal-02305447⟩

K. Le Barbu, F. Lahmani, A. Zehnacker-Rentien. Formation of Hydrogen-Bonded Structures in Jet-Cooled Complexes of a Chiral Chromophore Studied by IR/UV Double Resonance Spectroscopy: Diastereoisomeric Complexes of (±)-2-Naphthyl-1-ethanol with (±)-2-Amino-1-propanol. Journal of Physical Chemistry A, American Chemical Society, 2002, 106 (26), pp.6271-6278. ⟨10.1021/JP014673V⟩. ⟨hal-02305437⟩

F. Lahmani, M. Broquier, A. Zehnacker-Rentien. The o-cyanophenol dimer as studied by laser-induced fluorescence and IR fluorescence dip spectroscopy: a study of a symmetrical double hydrogen bond. Chemical Physics Letters, Elsevier, 2002, 354 (3-4), pp.337-348. ⟨10.1016/S0009-2614(02)00134-3⟩. ⟨hal-00915334⟩

F. Lahmani, A. Zehnacker-Rentien, M. Broquier. Electronic and vibrational spectroscopy of jet-cooled complexes of o-cyanophenol. Journal of Photochemistry and Photobiology A: Chemistry, Elsevier, 2002, 154 (1), pp.41-52. ⟨10.1016/S1010-6030(02)00312-X⟩. ⟨hal-00915335⟩

K. Le Barbu, F. Lahmani, M. Mons, M. Broquier, A. Zehnacker. IR-UV investigation of the structure of the 1-phenylethanol chromophore and its hydrated complexes. Physical Chemistry Chemical Physics, Royal Society of Chemistry, 2001, 3 (21), pp.4684-4688. ⟨10.1039/b105036m⟩. ⟨hal-00915440⟩

K. Le Barbu, F. Lahmani, M. Mons, M. Broquier, A. Zehnacker-Rentien. IR-UV investigation of the structure of the 1-phenylethanol chromophore and its hydrated complexes. Physical Chemistry Chemical Physics, Royal Society of Chemistry, 2001, 3, pp.4684-4688. ⟨10.1039/b105036m⟩. ⟨hal-00144687⟩

K. Le Barbu, A. Zehnacker-Rentien, F. Lahmani, M. Mons, F. Piuzzi, et al.. Spectroscopic studies of enantiomeric discrimination in jet-cooled chiral complexes. Chirality, Wiley, 2001, 13 (10), pp.715-721. ⟨10.1002/chir.10016⟩. ⟨hal-00144704⟩

V. Brenner, P. Millie, M. Broquier, F. Lahmani, A. Zehnacker-Rentien, et al.. Hydrogen-Bonded bridges in Complexes of o-Cyanophenol : Laser-Induced Fluorescence and IR/UV Double-Resonance Studies. Journal of Physical Chemistry A, American Chemical Society, 2001, 105, pp.6841-6850. ⟨10.1021/jp010218n⟩. ⟨hal-00136550⟩

M. Broquier, F. Lahmani, A. Zehnacker-Rentien, V. Brenner, Ph. Millié, et al.. Hydrogen-Bonded Bridges in Complexes of o -Cyanophenol: Laser-Induced Fluorescence and IR/UV Double-Resonance Studies. Journal of Physical Chemistry A, American Chemical Society, 2001, 105 (28), pp.6841-6850. ⟨10.1021/jp010218n⟩. ⟨hal-00915341⟩

K. Le Barbu, V. Brenner, Ph. Millié, F. Lahmani, A. Zehnacker-Rentien. An Experimental and Theoretical Study of Jet-Cooled Complexes of Chiral Molecules: The Role of Dispersive Forces in Chiral Discrimination. Journal of Physical Chemistry A, American Chemical Society, 1998, 102 (1), pp.128-137. ⟨10.1021/JP972465Q⟩. ⟨hal-02305345⟩

Ariel Pérez‐mellor, Anne Zehnacker. Chirality Effects in Jet-Cooled Cyclic Dipeptides. Physical Chemistry of Cold Gas-Phase Functional Molecules and Clusters, 21 (28), Springer Singapore, pp.63-87, 2019, ⟨10.1007/978-981-13-9371-6_3⟩. ⟨hal-02347943⟩

Ariel Pérez-Mellor, Anne Zehnacker. Chirality Effects in Jet-Cooled Cyclic Dipeptides. Takayuki Ebata; Masaaki Fujii. Physical Chemistry of Cold Gas-Phase Functional Molecules and Clusters, Springer Singapore, pp.63-87, 2019, 978-981-13-9370-9. ⟨10.1007/978-981-13-9371-6_3⟩. ⟨hal-03324659⟩

Ariel Pérez-Mellor, Anne Zehnacker. Chirality effects in jet-cooled cyclic dipeptides. Physical Chemistry of Cold Gas-Phase Functional Molecules and Clusters, pp.63-87, 2019. ⟨hal-03311636⟩

Taija L Fischer, Margarethe Bödecker, Anne Zehnacker, Ricardo A Mata, Martin A Suhm. Setting up the HyDRA blind challenge for the microhydration of organic molecules. 2021. ⟨hal-03423247⟩