AZ

Anne Zehnacker

119
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Publications

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The role of intramolecular hydrogen bonding in photoelectron circular dichroism: the diastereoisomers of 1-amino-2-indanol

Jennifer Dupont , Julien Vincent , Anne Zehnacker , Gustavo Garcia , Laurent Nahon et al.
Physical Chemistry Chemical Physics, 2025, 27 (5), pp.2739-2748. ⟨10.1039/d4cp04248d⟩
Article dans une revue hal-04966044 v1
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Proton tunneling, isotopic effects, and dealkylation reaction in tetra-tertbutyl porphycene: Supersonic jet spectroscopy revisited

Michał Gil , Ephriem Tadesse Mengesha , Michał Kijak , Anne Zehnacker-Rentien , Jerzy Sepioł et al.
The Journal of Chemical Physics, 2025, 163 (2), ⟨10.1063/5.0271560⟩
Article dans une revue hal-05164937 v1
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The genesis of OH-stretching vibrational circular dichroism in chiral molecular crystals

Sascha Jähnigen , Rodolphe Vuilleumier , Anne Zehnacker
Chemical Science, 2025, 16 (22), pp.9833-9842. ⟨10.1039/d4sc08055f⟩
Article dans une revue hal-05164877 v1
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Exploring Naproxen Cocrystals Through Solid‐State Vibrational Circular Dichroism

Adam Sklenář , Anne Zehnacker-Rentien , Jakub Kaminský , Jan Rohlíček , Petr Bouř
Chirality, 2025, 37 (3), pp.e70027. ⟨10.1002/chir.70027⟩
Article dans une revue hal-04966062 v1
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Conformer‐Selective Photoelectron Circular Dichroism

Etienne Rouquet , Jennifer Dupont , Valeria Lepere , Gustavo Garcia , Laurent Nahon et al.
Angewandte Chemie International Edition, 2024, 63 (17), ⟨10.1002/anie.202401423⟩
Article dans une revue hal-04732936 v1
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Enantioselective Complexation of Protonated Tyrosine by a Chiral Crown‐ether: The Nature of the Hydrogen Bonds Makes the Difference

Kien Vo , Keisuke Hirata , Bruno Martínez-Haya , Jos Oomens , Shun‐ichi Ishiuchi et al.
ChemPhysChem, 2024, pp.e202400880. ⟨10.1002/cphc.202400880⟩
Article dans une revue hal-04861276 v1
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Vibrational circular dichroism spectroscopy with a classical polarizable force field: alanine in the gas and condensed phases

Jessica Bowles , Sascha Jähnigen , Federica Agostini , Rodolphe Vuilleumier , Anne Zehnacker et al.
ChemPhysChem, 2024, 25 (8), pp.e202300982. ⟨10.1002/cphc.202300982⟩
Article dans une revue hal-04489317 v1
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Homochiral vs. heterochiral preference in chiral self-recognition of cyclic diols

Jennifer Dupont , Beppo Hartwig , Katia Le Barbu-Debus , Valéria Lepère , Régis Guillot, et al.
Physical Chemistry Chemical Physics, 2024, ⟨10.1039/d4cp00351a⟩
Article dans une revue hal-04504045 v1
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Benchmark experiments for numerical quantum chemistry

Ricardo Mata , Martin Suhm , A. Zehnacker-Rentien
Physical Chemistry Chemical Physics, 2023, 25 (39), pp.26415-26416. ⟨10.1039/d3cp90186f⟩
Article dans une revue hal-04333548 v1
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Subtle hydrogen bond preference and dual Franck–Condon activity – the interesting pairing of 2-naphthol with anisole

Arman Nejad , Ariel Pérez-Mellor , Manuel Lange , Ivan Alata , Anne Zehnacker et al.
Physical Chemistry Chemical Physics, 2023, 25 (15), pp.10427-10439. ⟨10.1039/d3cp00160a⟩
Article dans une revue hal-04239308 v1
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Lumière sur les molécules chirales

Anne Zehnacker
L'Actualité Chimique, 2023
Article dans une revue hal-04239473 v1
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Non-covalent interactions reveal the protein chain δ conformation in a flexible single-residue model

Zeynab Imani , V. Rao Mundlapati , Valérie Brenner , Eric Gloaguen , Katia Le Barbu-Debus et al.
Chemical Communications, 2023, ⟨10.1039/D2CC06658K⟩
Article dans une revue hal-03923111 v1
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Does Chiral Sensitivity of a Structure Depend on the Metal Core? Alkali Ion Complexes of Cyclo(Tyr-Tyr)

Koki Yoshizawa , Keisuke Hirata , Shun‐ichi Ishiuchi , Masaaki Fujii , Anne Zehnacker
ChemPhysChem, 2023, 24 (18), pp.e202300172. ⟨10.1002/cphc.202300172⟩
Article dans une revue hal-04239392 v1
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Induced photoelectron circular dichroism onto an achiral chromophore

Etienne Rouquet , Madhusree Roy Chowdhury , Gustavo A Garcia , Laurent Nahon , Jennifer Dupont et al.
Nature Communications, 2023, 14 (1), pp.6290. ⟨10.1038/s41467-023-42002-1⟩
Article dans une revue hal-04239788 v1
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The first HyDRA challenge for computational vibrational spectroscopy

Taija L Fischer , Margarethe Bödecker , Sophie M Schweer , Jennifer Dupont , Valéria Lepère et al.
Physical Chemistry Chemical Physics, 2023, 25 (33), pp.22089-22102. ⟨10.1039/D3CP01216F⟩
Article dans une revue hal-04239413 v1
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Photoelectron Circular Dichroism as a Signature of Subtle Conformational Changes: The Case of Ring Inversion in 1-Indanol

Jennifer Dupont , Valéria Lepère , Anne Zehnacker , Sebastian Hartweg , Gustavo A Garcia et al.
Journal of Physical Chemistry Letters, 2022, 13 (10), pp.2313-2320. ⟨10.1021/acs.jpclett.2c00074⟩
Article dans une revue hal-03775845 v1
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Do Stereochemical Effects Overcome a Charge-induced Perturbation in Isolated Protonated cyclo(Tyr-Tyr)?

Koki Yoshizawa , Keisuke Hirata , Shun-Ichi Ishiuchi , Masaaki Fujii , Anne Zehnacker
Journal of Physical Chemistry A, 2022, ⟨10.1021/acs.jpca.2c03789⟩
Article dans une revue hal-04239350 v1
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Jet-cooled laser spectroscopy and solid-state vibrational circular dichroism of the cyclo-(Tyr-Phe) diketopiperazine dipeptide

Jennifer Dupont , Régis Guillot , Valéria Lepère , Anne Zehnacker
Journal of Molecular Structure, 2022, 1262, pp.133059. ⟨10.1016/j.molstruc.2022.133059⟩
Article dans une revue hal-03736150 v1
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How change in chirality prevents β-amyloid type interaction in a protonated cyclic dipeptide dimer

Katia Le Barbu-Debus , Ariel Pérez-Mellor , Valéria Lepère , Anne Zehnacker
Physical Chemistry Chemical Physics, 2022, 24 (33), pp.19783 - 19791. ⟨10.1039/d2cp03110h⟩
Article dans une revue hal-03788936 v1
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Setting up the HyDRA blind challenge for the microhydration of organic molecules

Taija L Fischer , Margarethe Bödecker , Anne Zehnacker-Rentien , Ricardo A Mata , Martin A Suhm
Physical Chemistry Chemical Physics, 2022, 24 (19), pp.11442-11454. ⟨10.1039/d2cp01119k⟩
Article dans une revue hal-03736167 v2
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How Crystal Symmetry Dictates Non-Local Vibrational Circular Dichroism in the Solid State

Sascha Jähnigen , Katia Le Barbu-Debus , Régis Guillot , Rodolphe Vuilleumier , Anne Zehnacker
Angewandte Chemie International Edition, 2022, ⟨10.1002/anie.202215599⟩
Article dans une revue hal-03926814 v1
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How Symmetry Influences the Dissociation of Protonated Cyclic Peptides

Ariel F Pérez-Mellor , Riccardo Spezia , Anne Zehnacker
Symmetry, 2022, 14 (4), pp.679. ⟨10.3390/sym14040679⟩
Article dans une revue hal-03736143 v1
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Structure and Collision-Induced Dissociation of the protonated cyclo His-Phe Dipeptide: Mechanistic Studies and Stereochemical Effects

Ariel Pérez-Mellor , Katia Le Barbu-Debus , Valeria Lepere , Ivan Alata , Riccardo Spezia et al.
The European Physical Journal D : Atomic, molecular, optical and plasma physics, 2021, 75 (6), ⟨10.1140/epjd/s10053-021-00173-w⟩
Article dans une revue hal-03249830 v1
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Competition between inter and intramolecular hydrogen bond evidenced by vibrational circular dichroism spectroscopy: The case of (1S,2R)‐(−)‐cis‐1‐amino‐2‐indanol

Katia Le Barbu-Debus , Anne Zehnacker
Chirality, 2021, ⟨10.1002/chir.23362⟩
Article dans une revue hal-03356734 v1
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A theoretical and experimental case study of the hydrogen bonding predilection of S-methylcysteine

Venkateswara Rao Mundlapati , Zeynab Imani , Gildas Goldsztejn , Eric Gloaguen , Valérie Brenner et al.
Amino Acids, 2021, 53 (4), pp.621-633. ⟨10.1007/s00726-021-02967-z⟩
Article dans une revue hal-03186714 v1
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Computation of Solid-State Vibrational Circular Dichroism in the Periodic Gauge

Sascha Jähnigen , Anne Zehnacker , Rodolphe Vuilleumier
Journal of Physical Chemistry Letters, 2021, pp.7213-7220. ⟨10.1021/acs.jpclett.1c01682⟩
Article dans une revue hal-03311633 v1
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Stereospecific Collision-Induced Dissociation and Vibrational Spectroscopy of Protonated Cyclo (Tyr-Pro)

Ariel Pérez-Mellor , Ivan Alata , Valeria Lepere , Riccardo Spezia , Anne Zehnacker-Rentien
International Journal of Mass Spectrometry, 2021, 465, pp.116590. ⟨10.1016/j.ijms.2021.116590⟩
Article dans une revue hal-03195968 v1
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The reduced cohesion of homoconfigurational 1,2-diols

Beppo Hartwig , Manuel Lange , Anja Poblotzki , Robert Medel , Anne Zehnacker et al.
Physical Chemistry Chemical Physics, 2020, 22 (3), pp.1122-1136. ⟨10.1039/c9cp04943f⟩
Article dans une revue hal-02473832 v1
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Solid‐state synthesis of cyclo LD‐diphenylalanine: A chiral phase built from achiral subunits

Ariel Pérez‐mellor , Katia Le Barbu-Debus , Anne Zehnacker
Chirality, 2020, 32 (5), pp.693-703. ⟨10.1002/chir.23195⟩
Article dans une revue hal-02571724 v1
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Chiral discrimination between tyrosine and -cyclodextrin revealed by cryogenic ion trap infrared spectroscopy

Keisuke Hirata , Yuta Mori , Shun-Ichi Ishiuchi , Masaaki Fujii , Anne Zehnacker
Physical Chemistry Chemical Physics, 2020, ⟨10.1039/d0cp02968h⟩
Article dans une revue hal-02993740 v1
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Homochiral vs. heterochiral sodium core dimers of tartaric acid esters: A mass spectrometry and vibrational spectroscopy study

Katia Le Barbu-Debus , Debora Scuderi , Valéria Lepère , Anne Zehnacker
Journal of Molecular Structure, 2020, 1205, pp.127583. ⟨10.1016/j.molstruc.2019.127583⟩
Article dans une revue hal-02441869 v1
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Efficient incorporation and protection of lansoprazole in cyclodextrin metal-organic frameworks

Xue Li , Marianna Porcino , Charlotte Martineau-Corcos , Tao Guo , Ting Xiong et al.
International Journal of Pharmaceutics, 2020, 585, ⟨10.1016/j.ijpharm.2020.119442⟩
Article dans une revue hal-02844079 v1
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Assessing Cluster Models of Solvation for the Description of Vibrational Circular Dichroism Spectra: Synergy between Static and Dynamic Approaches

Katia Le Barbu-Debus , Jessica Bowles , Sascha Jähnigen , Carine Clavaguéra , Florent Calvo et al.
Physical Chemistry Chemical Physics, 2020, 22 (45), pp.26047-26068. ⟨10.1039/D0CP03869E⟩
Article dans une revue hal-03014777 v1

Glycoside scutellarin enhanced CD-MOF anchoring for laryngeal delivery

Marianna Porcino , Charlotte Martineau-Corcos , Weifeng Zhu , Gilles Patriarche , Christine Péchoux et al.
Acta Pharmaceutica Sinica B, 2020, 10 (9), pp.1709-1718. ⟨10.1016/j.apsb.2020.04.015⟩
Article dans une revue hal-03095979 v1
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Conformation control through concurrent N–H⋯S and N–H⋯O=C hydrogen bonding and hyperconjugation effects

Zeynab Imani , Venkateswara Rao Mundlapati , Gildas Goldsztejn , Valerie Brenner , Eric Gloaguen et al.
Chemical Science, 2020, 11, pp.9191-9197. ⟨10.1039/D0SC03339A⟩
Article dans une revue hal-02917912 v1
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Effects of complexation with sulfuric acid on the photodissociation of protonated Cinchona alkaloids in the gas phase

Feriel Ben Nasr , Ivan Alata , Debora Scuderi , Valéria Lepère , Valérie Brenner et al.
Physical Chemistry Chemical Physics, 2019, 21 (28), pp.15439-15451. ⟨10.1039/c9cp01518c⟩
Article dans une revue hal-02347956 v1
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Conformational Study of the Jet-Cooled Diketopiperazine Peptide Cyclo Tyrosyl-Prolyl

Ariel Pérez-Mellor , Ivan Alata , Valéria Lepère , Anne Zehnacker
Journal of Physical Chemistry B, 2019, 123 (28), pp.6023-6033. ⟨10.1021/acs.jpcb.9b04529⟩
Article dans une revue hal-02347969 v1
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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

Valérie Declerck , Ariel Pérez-Mellor , Régis Guillot , David Aitken , Michel Mons et al.
Chirality, 2019, 31 (8), pp.547-560. ⟨10.1002/chir.23083⟩
Article dans une revue hal-02347980 v1
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Can the Partial Peptide SIVSF of β 2 -Adrenergic Receptor Recognize Chirality of Epinephrine Neurotransmitter?

Masato Tamura , Tsubasa Sekiguchi , Shun-Ichi Ishiuchi , Anne Zehnacker-Rentien , Masaaki Fujii
Journal of Physical Chemistry Letters, 2019, ⟨10.1021/acs.jpclett.9b00184⟩
Article dans une revue hal-02070253 v1
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Effect of puckering motion and hydrogen bond formation on the vibrational circular dichroism spectrum of a flexible molecule: the case of ( S )-1-indanol

Katia Le Barbu-Debus , Arne Scherrer , Aude Bouchet , Daniel Sebastiani , Rodolphe Vuilleumier et al.
Physical Chemistry Chemical Physics, 2018, 20 (21), pp.14635-14646. ⟨10.1039/c8cp01695j⟩
Article dans une revue hal-02070261 v1

Stereochemistry-dependent structure of hydrogen-bonded protonated dimers: the case of 1-amino-2-indanol

Aude Bouchet , Johanna Klyne , Shun-Ichi Ishiuchi , Otto Dopfer , Masaaki Fujii et al.
Physical Chemistry Chemical Physics, 2018, 20 (18), pp.12430-12443. ⟨10.1039/c8cp00787j⟩
Article dans une revue hal-02070263 v1

Stereochemistry-dependent hydrogen bonds stabilise stacked conformations in jet-cooled cyclic dipeptides: (LD) vs. (LL) cyclo tyrosine–tyrosine

Feriel Bennasr , Ariel Pérez-Mellor , Ivan Alata , Valéria Lepère , Nejm-Eddine Jaïdane et al.
Faraday Discussions, 2018, 212, pp.399-419. ⟨10.1039/c8fd00079d⟩
Article dans une revue hal-02070257 v1

Molecules in confinement in clusters, quantum solvents and matrices: general discussion

Zlatko Bacic , David Benoit , Malgorzata Biczysko , Joël Bowman , Stephen Bradforth et al.
Faraday Discussions, 2018, 212, pp.569-601. ⟨10.1039/C8FD90053A⟩
Article dans une revue hal-02070258 v1

Precise characterisation of isolated molecules: general discussion

Zlatko Bacic , David Benoit , Matthieu Besemer , Joël Bowman , Stephen Bradforth et al.
Faraday Discussions, 2018, 212, pp.137-155. ⟨10.1039/C8FD90050G⟩
Article dans une revue hal-02070254 v1

Chirality effects in the structures of jet-cooled bichromophoric dipeptides

Ariel Pérez-Mellor , Valéria Lepère , Anne Zehnacker , Ivan Alata
Journal of Molecular Spectroscopy, 2018, 349, pp.71-84. ⟨10.1016/j.jms.2018.02.005⟩
Article dans une revue hal-02070260 v1

Quantum dynamics of isolated molecules: general discussion

Dmitri Babikov , David Benoit , Joël Bowman , Timothy Burd , David Clary et al.
Faraday Discussions, 2018, 212, pp.281-306. ⟨10.1039/C8FD90052C⟩
Article dans une revue hal-02070255 v1

Molecules in confinement in liquid solvents: general discussion

Loren Ban , Joël Bowman , Stephen Bradforth , Gilberte Chambaud , Martin Dracinsky et al.
Faraday Discussions, 2018, 212, pp.383-397. ⟨10.1039/C8FD90051E⟩
Article dans une revue hal-02070256 v1
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Molecular Recognition by a Short Partial Peptide of the Adrenergic Receptor: A Bottom-Up Approach

Tsubasa Sekiguchi , Masato Tamura , Hikari Oba , Pierre Çarçarbal , Rolando Rafael Lozada-Garcia et al.
Angewandte Chemie International Edition, 2018, 57 (20), pp.5626-5629. ⟨10.1002/anie.201712976⟩
Article dans une revue hal-02070265 v1
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Supersonic jet spectroscopy of parent hemiporphycene: Structural assignment and vibrational analysis for S 0 and S 1 electronic states

Sebastian Peukert , Michał Kijak , Jakub Ostapko , Jerzy Sepioł , Catherine Le Bris et al.
The Journal of Chemical Physics, 2018, 149 (13), pp.134307. ⟨10.1063/1.5048843⟩
Article dans une revue hal-02070259 v1
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Vibrational circular dichroism of a 2,5-diketopiperazine (DKP) peptide: Evidence for dimer formation in cyclo LL or LD diphenylalanine in the solid state

Ariel Pérez-Mellor , Anne Zehnacker
Chirality, 2017, 29 (2), pp.89-96. ⟨10.1002/chir.22674⟩
Article dans une revue hal-02347991 v1

Does the Residues Chirality Modify the Conformation of a Cyclo-Dipeptide? Vibrational Spectroscopy of Protonated Cyclo-diphenylalanine in the Gas Phase

Ivan Alata , Ariel Pérez-Mellor , Feriel Ben Nasr , Debora Scuderi , Vincent Steinmetz et al.
Journal of Physical Chemistry A, 2017, 121 (38), pp.7130-7138. ⟨10.1021/acs.jpca.7b06159⟩
Article dans une revue hal-02348003 v1
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Competition between inter-and intra-molecular hydrogen bonding: An infrared spectroscopic study of jet-cooled amino-ethanol and its dimer

Pierre Asselin , Bruno Madebène , Pascale Soulard , Robert Georges , Manuel Goubet et al.
The Journal of Chemical Physics, 2016, 145 (22), pp.224313. ⟨10.1063/1.4972016⟩
Article dans une revue hal-01468104 v1

Chirality-dependent structuration of protonated or sodiated polyphenylalanines: IRMPD and ion mobility studies

Valéria Lepère , Katia Le Barbu-Debus , Carine Clavaguera , D. Scuderi , Giovanni Piani et al.
Physical Chemistry Chemical Physics, 2016, 18 (3), pp.1807-18017. ⟨10.1039/c5cp06768e⟩
Article dans une revue hal-01356198 v1

Photofragmentation mechanisms in protonated chiral cinchona alkaloids

Sunil Kumar , Bruno Lucas , Jacqueline Fayeton , Debora Scuderi , Ivan Alata et al.
Physical Chemistry Chemical Physics, 2016, 18 (32), pp.22668 - 22677. ⟨10.1039/C6CP04041A⟩
Article dans une revue hal-01385253 v1

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

Mohammad Alauddin , Eric Gloaguen , Valérie Brenner , Benjamin Tardivel , Michel Mons et al.
Chemistry - A European Journal, 2015, 21 (46), pp.16479-16493 ⟨10.1002/chem.201501794⟩
Article dans une revue istex cea-01273006 v1

Unraveling non-covalent interactions within flexible biomolecules: from electron density topology to gas phase spectroscopy

R. Chaudret , B. De Courcy , J. Contreras-García , Eric Gloaguen , A. Zehnacker-Rentien et al.
Physical Chemistry Chemical Physics, 2014, 16, pp.9876-9891. ⟨10.1039/C3CP52774C⟩
Article dans une revue hal-01131254 v1

IR–UV spectroscopy of jet-cooled 1-indanol: Restriction of the conformational space by hydration

Aude Bouchet , Jonas Altnöder , Michel Broquier , A. Zehnacker
Journal of Molecular Structure, 2014, 1076, pp.344-351. ⟨10.1016/j.molstruc.2014.07.061⟩
Article dans une revue hal-01080713 v1

Direct Spectroscopic Evidence of Hyperconjugation Unveils the Conformational Landscape of Hydrazides†

Eric Gloaguen , V. Brenner , M. Alauddin , B. Tardivel , M. Mons et al.
Angewandte Chemie International Edition, 2014, 53 (50), pp.13756-13759. ⟨10.1002/anie.201407801⟩
Article dans une revue istex hal-01131234 v1

Conformational Analysis of Quinine and Its Pseudo Enantiomer Quinidine: A Combined Jet-Cooled Spectroscopy and Vibrational Circular Dichroism Study

A. Sen , Alexandra Bouchet , V. Lepere , Barbu-Debus K. Le , D. Scuderi et al.
Journal of Physical Chemistry A, 2012, 116 (32), pp.8334-8344. ⟨10.1021/jp3047888⟩
Article dans une revue hal-00755557 v2

The role of weak hydrogen bonds in chiral recognition

D. Scuderi , Katia Le Barbu-Debus , A. Zehnacker
Physical Chemistry Chemical Physics, 2011, 13 (40), pp.17916. ⟨10.1039/C1CP20987F⟩
Article dans une revue hal-02305440 v1

Jet-cooled hydrates of Chiral (S) 1,2,3,4-tetrahydro-3-isoquinoline methanol (THIQM): structure and mechanism of formation

Katia Le Barbu-Debus , Ananya Sen , Michel Broquier , Anne Zehnacker-Rentien
Physical Chemistry Chemical Physics, 2011, 13, pp.13985-13991. ⟨10.1039/c1cp20939f⟩
Article dans une revue hal-00915267 v1

Excited-state intramolecular proton transfer reaction modulated by low-frequency vibrations: An effect of an electron-donating substituent on the dually fluorescent bis-benzoxazole

J. Sepioł , A. Grabowska , P. Borowicz , M. Kijak , Michel Broquier et al.
The Journal of Chemical Physics, 2011, 135 (3), pp.034307. ⟨10.1063/1.3609759⟩
Article dans une revue hal-00915272 v1

Chiral recognition in cinchona alkaloid protonated dimers: Mass spectrometry and UV photodissociation studies

Debora Scuderi , Philippe Maître , Flaminia Rondino , Katia Le Barbu-Debus , Valeria Lepère et al.
Journal of Physical Chemistry A, 2010, 114 (9), pp.3306-3312. ⟨10.1021/jp9094497⟩
Article dans une revue hal-03617120 v1

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.

K. Le Barbu-Debus , M. Broquier , A. Mahjoub , A. Zehnacker-Rentien
Physical Chemistry Chemical Physics, 2009, 11 (35), pp.7589-98
Article dans une revue hal-00915290 v1

Chiral recognition in jet-cooled complexes of (1R,2S)-(+)-cis-1-amino-2- indanol and methyl lactate: On the importance of the CH⋯π interaction

Katia Le Barbu-Debus , Michel Broquier , Ahmed Mahjoub , Anne Zehnacker-Rentien
Physical Chemistry Chemical Physics, 2009, ⟨10.1039/b906834a⟩
Article dans une revue istex hal-03617125 v1

Chiral recognition between alpha-hydroxylesters: a double-resonance IR/UV study of the complexes of methyl mandelate with methyl glycolate and methyl lactate.

Katia Le Barbu-Debus , Michel Broquier , Ahmed Mahjoub , Anne Zehnacker-Rentien
Journal of Physical Chemistry A, 2008, 112 (40), pp.9731-41. ⟨10.1021/jp711546p⟩
Article dans une revue istex hal-00915259 v1

Localization of electronic and vibrational energy in the jet-cooled m-cyanophenol/o-cyanophenol dimer: laser induced fluorescence and fluorescence-dip IR spectra

K. Le Barbu-Debus , M. Broquier , F. Lahmani , A. Zehnacker-Rentien
Molecular Physics, 2005, 103 (11-12), pp.1655-1662
Article dans une revue hal-00915305 v1

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

N. Seurre , K. Le Barbu-Debus , F. Lahmani , A. Zehnacker-Rentien , Jerzy Sepioł
Chemical Physics, 2003, 295 (1), pp.21-33. ⟨10.1016/J.CHEMPHYS.2003.07.009⟩
Article dans une revue istex hal-02305447 v1

The o-cyanophenol dimer as studied by laser-induced fluorescence and IR fluorescence dip spectroscopy: a study of a symmetrical double hydrogen bond

F. Lahmani , M. Broquier , A. Zehnacker-Rentien
Chemical Physics Letters, 2002, 354 (3-4), pp.337-348. ⟨10.1016/S0009-2614(02)00134-3⟩
Article dans une revue istex hal-00915334 v1

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

K. Le Barbu , F. Lahmani , A. Zehnacker-Rentien
Journal of Physical Chemistry A, 2002, 106 (26), pp.6271-6278. ⟨10.1021/JP014673V⟩
Article dans une revue istex hal-02305437 v1

Electronic and vibrational spectroscopy of jet-cooled complexes of o-cyanophenol

F. Lahmani , A. Zehnacker-Rentien , M. Broquier
Journal of Photochemistry and Photobiology A: Chemistry, 2002, 154 (1), pp.41-52. ⟨10.1016/S1010-6030(02)00312-X⟩
Article dans une revue istex hal-00915335 v1

Hydrogen-Bonded bridges in Complexes of o-Cyanophenol : Laser-Induced Fluorescence and IR/UV Double-Resonance Studies

V. Brenner , P. Millie , M. Broquier , F. Lahmani , A. Zehnacker-Rentien et al.
Journal of Physical Chemistry A, 2001, 105, pp.6841-6850. ⟨10.1021/jp010218n⟩
Article dans une revue istex hal-00136550 v1

Hydrogen-Bonded Bridges in Complexes of o -Cyanophenol: Laser-Induced Fluorescence and IR/UV Double-Resonance Studies

M. Broquier , F. Lahmani , A. Zehnacker-Rentien , V. Brenner , Ph. Millié et al.
Journal of Physical Chemistry A, 2001, 105 (28), pp.6841-6850. ⟨10.1021/jp010218n⟩
Article dans une revue istex hal-00915341 v1

IR-UV investigation of the structure of the 1-phenylethanol chromophore and its hydrated complexes

K. Le Barbu , F. Lahmani , M. Mons , M. Broquier , A. Zehnacker
Physical Chemistry Chemical Physics, 2001, 3 (21), pp.4684-4688. ⟨10.1039/b105036m⟩
Article dans une revue istex hal-00915440 v1

IR-UV investigation of the structure of the 1-phenylethanol chromophore and its hydrated complexes

K. Le Barbu , F. Lahmani , M. Mons , M. Broquier , A. Zehnacker-Rentien
Physical Chemistry Chemical Physics, 2001, 3, pp.4684-4688. ⟨10.1039/b105036m⟩
Article dans une revue istex hal-00144687 v1

Spectroscopic studies of enantiomeric discrimination in jet-cooled chiral complexes

K. Le Barbu , A. Zehnacker-Rentien , F. Lahmani , M. Mons , F. Piuzzi et al.
Chirality, 2001, 13 (10), pp.715-721. ⟨10.1002/chir.10016⟩
Article dans une revue istex hal-00144704 v1

An Experimental and Theoretical Study of Jet-Cooled Complexes of Chiral Molecules: The Role of Dispersive Forces in Chiral Discrimination

K. Le Barbu , V. Brenner , Ph. Millié , F. Lahmani , A. Zehnacker-Rentien
Journal of Physical Chemistry A, 1998, 102 (1), pp.128-137. ⟨10.1021/JP972465Q⟩
Article dans une revue istex hal-02305345 v1
Image document

Chirality Effects in Jet-Cooled Cyclic Dipeptides

Ariel Pérez-Mellor , Anne Zehnacker
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⟩
Chapitre d'ouvrage hal-03324659 v2

Structure of Flexible Chiral Molecules and Unconventional Solvents by Vibrational Circular Dichroism Spectroscopyconventional Solvents

Anne Zehnacker
VOA8th (8th Conference onVibrational Optical Activity), Christian Merten, Aug 2024, Bochum (RUB), Germany
Communication dans un congrès hal-04732971 v1

Conformer-selective Photoelectron Circular Dichroism

Anne Zehnacker
“Molecular Recognition Mechanism between Flexible Molecules”, Masaaki Fujii; Shun-ichi Ishiuchi, Jul 2024, Tokyo (Japan), Japan
Communication dans un congrès hal-04732987 v1

Vibrational Circular Dichroism of Strongly Interacting Systems

Anne Zehnacker
VOA 2024, Christian Merten, Aug 2024, Bochum, Germany
Communication dans un congrès hal-04965886 v1

Conformer-Selective Spectroscopy of Chiral Molecules

Anne Zehnacker
Fritz Haber Molecular Physics Department Workshop, Sandra Eibenberger-Arias, Nov 2024, Tegernsee, Germany
Communication dans un congrès hal-04966009 v1

Conformer-selective spectroscopic studies of chiral molecules: from structure to chiroptical spectroscopy

Anne Zehnacker
7th International Symposium of JSPS Core-to-Core Program on “Molecular Recognition Mechanism between Flexible Molecules”, Shun-ichi Ishiuchi, Jul 2024, Tokyo, Japan
Communication dans un congrès hal-04965926 v1

Induced Photoelectron Circular Dichroism (PECD)

Etienne Rouquet , Valéria Lepère , Anne Zehnacker , Gustavo A Garcia , Laurent Nahon
Workshop Photoemission of diluted samples, Sep 2023, Aussois, France
Communication dans un congrès hal-04332064 v1

Spectroscopy of chiral molecules

Etienne Rouquet , Valéria Lepère , Jennifer Dupont , Katia Le Barbu-Debus , Keisuke Hirata et al.
Réunion du GDR Chirafun, Nov 2023, Rennes (FRA), France
Communication dans un congrès hal-04346184 v1

Chirality Effects in the Structure and Reactivity of Biomolecular Ions and Complexes

Jennifer Dupont , Etienne Rouquet , Gustavo Garcia , Sebastian Hartweg , Laurent Nahon Koki Yoshizawa et al.
Gordon Conference "Gaseous Ions: Structures, Energetics and Reactions", Feb 2023, Ventura (CA), United States
Communication dans un congrès hal-04346180 v1

Dichroïsme circulaire de photoelectron (PECD) spécifique en conformère à deux photons du 1-indanol

Etienne Rouquet , Gustavo A Garcia , Laurent Nahon , Valéria Lepère , Anne Zehnacker
26ème Congrès général de la SFP, Jul 2023, Paris, France
Communication dans un congrès hal-04332058 v1

Induced Photoelectron Circular Dichroism

Etienne Rouquet , Gustavo A Garcia , Laurent Nahon , Valéria Lepère , Anne Zehnacker
4th International Symposium of JSPS Core-to-core program on “Molecular Recognition Mechanism between Flexible Molecules”, Jan 2023, Orsay, France
Communication dans un congrès hal-04332049 v1

Conformer-specific photoelectron circular dichroism

Etienne Rouquet , Jennifer Dupont , Gustavo Garcia , Sebastian Hartweg , Laurent Nahon et al.
Photoemission of diluted sample, Sep 2023, Aussois (Savoie), France
Communication dans un congrès hal-04346181 v1

Two-photon conformer-specific Photoelectron Circular Dichroism (PECD) of 1-indanol

Etienne Rouquet , Valéria Lepère , Anne Zehnacker
5th International Symposium of JSPS Core-to-core program on “Molecular Recognition Mechanism between Flexible Molecules”, Oct 2023, Berlin, Germany
Communication dans un congrès hal-04332084 v1

Induced Photoelectron Circular Dichroism onto an achiral chromophore

Etienne Rouquet , Jennifer Dupont , Gustavo Garcia , Madhusree Roy-Chowdhury , Laurent Nahon et al.
Core-2-Core Symposium, Oct 2023, Berlin (Germany), Germany
Communication dans un congrès hal-04346183 v1

Vibrational Circular Dichroism as a probe of the structure of crystals

Titouan Martenot , Sascha Jähnigen , Rodolphe Vuilleumier , Katia Le Barbu-Debus , Anne Zehnacker
Congrès Général de la Société Française de Physique, Jul 2023, Paris, France
Communication dans un congrès hal-04346187 v1

Photoelectron circular dichroism as a probe for conformational isomerism in 1-indanol

Jennifer Dupont , Valeria Lepere , Anne Zehnacker , Sebastian Hartweg , Laurent Nahon et al.
Soleil Users’Meeting 2022, Jan 2022, Saint-Aubin SOLEIL, France
Communication dans un congrès hal-04327129 v1

Spectroscopic studies of chirality

Jennifer Dupont , Ariel Pérez-Mellor , Katia Le Barbu-Debus , Valéria Lepère , Sebastian Hartweg et al.
International Symposium on Molecular Spectroscopy, Jun 2022, Urbana (Illinois), United States
Communication dans un congrès hal-04333551 v1

Spectroscopy and chirality: what neighbours share

Anne Zehnacker-Rentien
40 years of spectroscopy, Sep 2022, Orsay, France
Communication dans un congrès hal-04337481 v1

Chiroptical spectroscopy of flexible molecules at low and room temperature

Jennifer Dupont , Masato Tamura , Tsubasa Sekiguchi , Shun-Ichi Ishiuchi , Masaaki Fujii et al.
Chemistry and Physics at low temperature (CPLT 2022), Jul 2022, Visegrád, Hungary, Hungary
Communication dans un congrès hal-04342400 v1

What circular dichroism spectroscopy teaches us about solvation

Sascha Jähnigen , Jessica Bowles , Jennifer Dupont , Sébastien Hartweg , Madhusree Roy Chowdhury et al.
Rencontres du GDR Solvate, May 2022, Paris, France
Communication dans un congrès hal-04337471 v1

Conformation isomerism of 1-indanol probe by photoelectron circular dichroism

Valéria Lepère , Jennifer Dupont , Anne Zehnacker , Laurent Nahon , Gustavo A Garcia et al.
Journées annuelles SPEP'2022, Jun 2022, Ens Paris-Saclay, Cachan, France
Communication dans un congrès hal-04381610 v1

Computation of Vibrational Circular Dichroism in the Periodic Gauge

Sascha Jähnigen , Jessica Bowles , Carine Clavaguera , Florent Calvo , Anne Zehnacker et al.
7th International Conference on Vibrational Optical Activity, Aug 2022, Edmonton, Canada
Communication dans un congrès hal-04337537 v1

In the wake of molecular photophysics : a spectroscopic journey

Anne Zehnacker
Photons, Molécules et la Vie : un Hommage à Sydney Leach, Sep 2022, Meudon Bellevue, France
Communication dans un congrès hal-04337495 v1

Chirality Effects in Molecular Structure and Recognition: a Spectroscopic Study

Tamura M. , Mori Y. , Sekiguchi T. , Ariel Pérez-Mellor , Alata I. et al.
Rencontres de chimie physique 2021, Sep 2021, Sète (France), France
Communication dans un congrès hal-04332211 v1

Chirality Effects in Molecular Structure and Recognition: a Spectroscopic Study

Mori Yuta , Pérez-Mellor Ariel , Katia Le Barbu-Debus , Hirata Keisuke , Valéria Lepère et al.
French Swiss Photochemistry Symposium, Jan 2021, Genève (on line), Switzerland
Communication dans un congrès hal-04332177 v1

Study of (solid) state biomolecules by (vibrational) circular dichroism” au symposium

Sascha Jähnigen , Jennifer Dupont , Rodolphe Vuilleumier , Sebastian Hartweg , Gustavo Garcia et al.
Pacifichem Symposium“New Frontier in Fundamental Science of Molecular Chirality, Dec 2021, Honolulu (Online), United States
Communication dans un congrès hal-04335975 v1

Photoelectron circular dichroism as a probe for conformational isomerism in 1-indanol

Jennifer Dupont , Valeria Lepere , Anne Zehnacker , Sebastian Hartweg , Laurent Nahon et al.
GDR Chirafun, Apr 2021, Paris (en ligne), France
Communication dans un congrès hal-04327168 v1

Probing the Structure of Chiral Molecules and their Interactions: from Laser Spectroscopy to Circular Dichroism

Katia Le Barbu-Debus , Masaaki Fujii , Shun-Ichi Ishiuchi , Keisuke Hirata , Arne Scherrer et al.
Réunion CECAM Benchmarking of electronic structure methods for non-covalent interactions, Nov 2021, Marne La Vallée, France
Communication dans un congrès hal-04335850 v1

Photoelectron circular dichroism as a probe for conformational isomerism in 1-indanol

Jennifer Dupont , Valéria Lepère , Anne Zehnacker , Sebastian Hartweg , Laurent Nahon et al.
GDR EMIE – Atelier thématique : Grands Instruments pour la physico-chimie moléculaire, Oct 2021, Paris (en ligne), France
Communication dans un congrès hal-04327181 v1

Chirality effects in the structure and fragmentation of biomolecular clusters au symposium

Ariel Pérez-Mellor , Riccardo Spezzia , Masaaki Fujii , Shun Ichi Ishiuchi , Keisuke Hirata et al.
Pacifichem Symposium““Structure and function of complex molecular clusters - challenges in theory and experiment”, Dec 2021, Honolulu (Online), United States
Communication dans un congrès hal-04336028 v1

Etude de dicétopipérazines par spectroscopies

Jennifer Dupont , Valeria Lepere , Anne Zehnacker
PhotOnline, Oct 2020, Paris (en ligne), France
Communication dans un congrès hal-04327190 v1

Chiral recognition in the gas phase

Anne Zehnacker-Rentien , Masato Tamura , Yuta Mori , Tsubasa Sekiguchi , Keisuke Hirata et al.
World Reseach Hub Initiative Symposium, Nov 2020, Tokyo (Online), Japan
Communication dans un congrès hal-04332158 v1

Flexible chiral molecules: from supersonic expansions to solid-state spectroscopy

Ariel Pérez-Mellor , Aude Bouchet , Valérie Declerck , David J. Aitken , Mohammad Alauddin et al.
Ecole d’été du Collaborative Research Centre 1319 "ELCH" (Extreme Light for sensing and driving molecular CHirality) de l’Université de Kassel, Sep 2019, Bad Arolsen, Germany
Communication dans un congrès hal-04335692 v1

Discrimination chirale au sein de dicétopipérazines

Jennifer Dupont , Yassin El Koulali , Ariel F Perez-Mellor , Feriel Ben Nasr , Ivan Alata et al.
Rencontres de Chimie Physique, Oct 2019, Biarritz (France), France
Communication dans un congrès hal-04327233 v1

Vibrational circular dichroism study of the solid-state organisation of ring-containing peptides

Ariel Pérez-Mellor , Valérie Declerck , David J. Aitken , Anne Zehnacker
Chirality 2019, Jul 2019, Bordeaux (France), France
Communication dans un congrès hal-04346186 v1

Clustering of Flexible Chiral Molecules: Supersonic Expansion vs. Solid-State spectroscopy

Ariel Pérez-Mellor , Valérie Declerck , David J. Aitken , Mohammad Alauddin , Eric Gloaguen et al.
International Symposium Frontiers in Cluster Science: Structure and Dynamics, Otto Dopfer, Nov 2019, Berlin (DE), Germany
Communication dans un congrès hal-04335784 v1

Stereochemistry-dependent Hydrogen Bonds Stabilise Stacked Conformations in Jet-Cooled Cyclic Dipeptides: (LD) vs. (LL) cyclo Tyrosine Tyrosine

Feriel BenNasr , Ivan Alata , Nejmeddine Jaïdane , Ariel Pérez-Mellor , Valéria Lepère et al.
Quantum Effects in Small Molecular Systems Faraday Discussion, Sep 2018, Edinburgh (Ecosse), United Kingdom
Communication dans un congrès hal-04333563 v1

The Role of Chirality in the Conformational Preference of Dipeptides

Ivan Alata , Feriel BenNasr , Ariel F Pérez-Mellor , Valéria Lepère , Katia Le Barbu-Debus et al.
Conference of the American Chemical Society, Mar 2018, La nouvelle Orléans, United States
Communication dans un congrès hal-04333556 v1

Chirality and Environment effects on the photofragmentation of cinchona alkaloids

Feriel Ben Nasr , Ivan Alata , Aude Bouchet , D. Scuderi , Valéria Lepère et al.
Stereodynamics 2018, Sep 2018, Arosa, Switzerland
Communication dans un congrès hal-04333562 v1

Stereoselective molecular interactions and clustering in isolated biomolecules

Ariel Pérez-Mellor , Feriel BenNasr , Ivan Alata , Valéria Lepère , Katia Le Barbu-Debus et al.
Molecular Interactions and Dynamics Gordon Research Conference, Jul 2018, Stonehill College in Easton, MA, United States
Communication dans un congrès hal-04333560 v1

Conformational study of DL & LL-diphenylalanine molecule in the gas-phase

Ariel F Perez-Mellor , Ivan Alata , Valeria Lepere , Anne Zehnacker
Workshop on Atomic and Molecular Physics (WAMP), Jun 2015, Varadero, Cuba
Communication dans un congrès hal-04327140 v1

Influence de la chiralité au sein de poly-phénylalanines

Valeria Lepere , Katia Le Barbu-Debus , Anne Zehnacker , Ivan Alata , Ariel F Perez-Mellor
GDR EMIE, Jun 2015, Biarritz (France), France
Communication dans un congrès hal-04327247 v1