Elise Dumont

149
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Publications

Truncated PNA-functionalized porous silicon biosensor for low-cost and early detection of troponin T in myocardial infarction

Maria Grazia Nolli , Alessio Bartocci , Caterina de Rosa , Andrea Patrizia Falanga , Vincenzo Abbate et al.

Talanta, 2026, 299, pp.129054. ⟨10.1016/j.talanta.2025.129054⟩

Article dans une revue hal-05396534v1

Synergistic action of crystallophore and imaging‐crystallophore enhances the production and imaging of protein crystals

Margaux Roux , Amandine Roux , Thomas Boukéké-Lespulier , François Riobé , Christian Chapelle et al.

Angewandte Chemie International Edition, 2026, 65 (7), ⟨10.1002/anie.202525011⟩

Article dans une revue hal-05512866v1

Insight into rifampicin resistance behind discordant mutations in RpoB of Mycobacterium tuberculosis: A molecular dynamics simulations study

Muhammad Tahir Khan , Elise Dumont , Jialou Zhu , Kashif Iqbal Sahibzada , Madeeha Shahzad Lodhi et al.

Results in Chemistry, 2025, 16, pp.102380. ⟨10.1016/j.rechem.2025.102380⟩

Article dans une revue hal-05396543v1

Calixarenes meet (TG4T)4 G-quadruplex: Exploring reciprocal interactions to develop innovative biotechnological applications

Andrea Patrizia Falanga , Maria Cremonini , Alessio Bartocci , Maria Grazia Nolli , Monica Terracciano et al.

International Journal of Biological Macromolecules, 2025, 305, pp.141331. ⟨10.1016/j.ijbiomac.2025.141331⟩

Article dans une revue hal-05396559v1

Multi-Epitopic Peptide Vaccine Against Newcastle Disease Virus: Molecular Dynamics Simulation and Experimental Validation

Muhammad Tariq Zeb , Elise Dumont , Muhammad Tahir Khan , Aroosa Shehzadi , Irshad Ahmad

Vaccines, 2024, 12 (11), pp.1250. ⟨10.3390/vaccines12111250⟩

Article dans une revue hal-05396582v1
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Influence of chemical modifications of the crystallophore on protein nucleating properties and supramolecular interactions network

Amandine Roux , Zaynab Alsalman , Tao Jiang , Jean-Christophe Mulatier , Delphine Pitrat et al.

Chemistry - A European Journal, 2024, 30 (38), pp.e202400900. ⟨10.1002/chem.202400900⟩

Article dans une revue hal-04630133v1
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DNA damage and repair in the nucleosome: insights from computational methods

Natacha Gillet , Elise Dumont , Emmanuelle Bignon

Biophysical Reviews, 2024, 16 (3), pp.345-356. ⟨10.1007/s12551-024-01183-9⟩

Article dans une revue hal-04743222v1
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One touch is all it takes: the supramolecular interaction between ubiquitin and lanthanide complexes revisited by paramagnetic NMR and molecular dynamics

Karen dos Santos , Alessio Bartocci , Natacha Gillet , Sandrine Denis-Quanquin , Amandine Roux et al.

Physical Chemistry Chemical Physics, 2024, 26 (20), pp.14573 - 14581. ⟨10.1039/d4cp00463a⟩

Article dans une revue hal-04609190v1
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A new G-quadruplex-specific photosensitizer inducing genome instability in cancer cells by triggering oxidative DNA damage and impeding replication fork progression

Marco Deiana , José María Andrés Castán , Pierre Josse , Abraha Kahsay , Darío Puchán Sánchez et al.

Nucleic Acids Research, 2023, 51 (12), pp.6264-6285. ⟨10.1093/nar/gkad365⟩

Article dans une revue hal-04247125v1

Molecular Basis of the pH-Controlled Maturation of the Tick-Borne Encephalitis Flavivirus

Emmanuelle Bignon , Elise Dumont , Antonio Monari

Journal of Physical Chemistry Letters, 2023, 14 (7), pp.1977-1982. ⟨10.1021/acs.jpclett.2c03551⟩

Article dans une revue hal-04487441v1
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Self-assembly of achiral building blocks into chiral cyclophanes using non-directional interactions

Yuan Zhang , Benjamin Ourri , Pierre-Thomas Skowron , Emeric Jeamet , Titouan Chetot et al.

Chemical Science, 2023, 14 (26), pp.7126-7135. ⟨10.1039/d3sc01235b⟩

Article dans une revue hal-04239440v1

How SARS-CoV-2 alters the regulation of gene expression in infected cells

Emmanuelle Bignon , Stéphanie Grandemange , Elise Dumont , Antonio Monari

Journal of Physical Chemistry Letters, 2023, 14 (13), pp.3199-3207. ⟨10.1021/acs.jpclett.3c00582⟩

Article dans une revue hal-04258968v1

Rationalizing the environment-dependent photophysical behavior of a DNA luminescent probe by classical and non-adiabatic molecular dynamics simulations

Antonio Monari , Alain Burger , Elise Dumont

Photochemical & Photobiological Sciences , 2023, 22 (9), pp.2081-2092. ⟨10.1007/s43630-023-00431-3⟩

Article dans une revue hal-04476961v1
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DNA–Histone Cross-Link Formation via Hole Trapping in Nucleosome Core Particles

Tingyu Wen , Maxime Kermarrec , Elise Dumont , Natacha Gillet , Marc Greenberg

Journal of the American Chemical Society, 2023, 145 (43), pp.23702-23714. ⟨10.1021/jacs.3c08135⟩

Article dans une revue hal-04498862v1

Reactivity of singlet oxygen with DNA, an update

Jean-Luc Ravanat , Elise Dumont

Photochemistry and Photobiology, 2022, 98 (3), pp.564-571. ⟨10.1111/php.13581⟩

Article dans une revue hal-03512824v1
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Ni-Centered Coordination-Induced Spin-State Switching Triggered by Electrical Stimulation

Shaymaa Al Shehimy , Orsola Baydoun , Sandrine Denis-Quanquin , Jean-Christophe Mulatier , Lhoussain Khrouz et al.

Journal of the American Chemical Society, 2022, 144 (39), pp.17955-17965. ⟨10.1021/jacs.2c07196⟩

Article dans une revue hal-03855661v1

How Fragile We Are: Influence of Stimulator of Interferon Genes (STING) Variants on Pathogen Recognition and Immune Response Efficiency

Jeremy Morere , Cécilia Hognon , Tom Miclot , Tao Jiang , Elise Dumont et al.

Journal of Chemical Information and Modeling, 2022, 62 (12), pp.3096-3106. ⟨10.1021/acs.jcim.2c00315⟩

Article dans une revue hal-04157319v1
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Synthesis and Electrochemistry of Free-Base Porphyrins Bearing Trifluoromethyl meso-Substituents

Shaymaa Al Shehimy , Denis Frath , Elise Dumont , Floris Chevallier , Christophe Bucher

ChemElectroChem, 2022, 9 (5), ⟨10.1002/celc.202101604⟩

Article dans une revue hal-03798363v1

The Behavior of Triplet Thymine in a Model B‐DNA Strand. Energetics and Spin Density Localization Revealed by ab initio Molecular Dynamics Simulations † *

Laleh Allahkaram , Antonio Monari , Elise Dumont

Photochemistry and Photobiology, 2021, 98 (3), pp.633-639. ⟨10.1111/php.13549⟩

Article dans une revue hal-04905812v1
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Organo-polyoxometalate-Based Hydrogen-Bond Catalysis

Debora Vilona , Moreno Lelli , Elise Dumont , Emmanuel Lacôte

Chemistry - A European Journal, In press

Article dans une revue hal-03376764v1

Synthesis and Properties of Higher Nuclearity Polyazanes

Maurice Médebielle , Thomas Criton , Debora Vilona , Guy Jacob , Elise Dumont et al.

Chemistry - A European Journal, 2021, 27 (11), pp.3670-3674. ⟨10.1002/chem.202004830⟩

Article dans une revue hal-03450809v1
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Light-induced in situ chemical activation of a fluorescent probe for monitoring intracellular G-quadruplex structures

Marco Deiana , Maëlle Mosser , Tangui Le Bahers , Elise Dumont , Marta Dudek et al.

Nanoscale, 2021, 13, pp.13795 - 13808. ⟨10.1039/d1nr02855c⟩

Article dans une revue hal-03590673v1
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Electron-Triggered Metamorphism in Palladium-Driven Self-Assembled Architectures

Christophe Kahlfuss , Shagor Chowdhury , Adérito Fins Carreira , Raymond Grüber , Elise Dumont et al.

Inorganic Chemistry, 2021, 60 (6), pp.3543-3555. ⟨10.1021/acs.inorgchem.0c02365⟩

Article dans une revue hal-03206835v1
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Assessing the sequence dependence of pyrimidine–pyrimidone (6–4) photoproduct in a duplex double-stranded DNA: A pitfall for microsecond range simulation

Natacha Gillet , Alessio Bartocci , Elise Dumont

The Journal of Chemical Physics, 2021, 154 (13), pp.135103. ⟨10.1063/5.0041332⟩

Article dans une revue hal-03423537v1
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Monte Carlo simulation of free radical production under keV photon irradiation of gold nanoparticle aqueous solution. Part II: Local primary chemical boost

Floriane Poignant , Hela Charfi , Chen-Hui Chan , Elise Dumont , David Loffreda et al.

Radiation Physics and Chemistry, 2021, 179, pp.109161. ⟨10.1016/j.radphyschem.2020.109161⟩

Article dans une revue hal-03029595v1
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Capturing The Dynamic Association Between A Tris-Dipicolinate Lanthanide Complex And A Decapeptide: A Combined Paramagnetic NMR And Molecular Dynamics Exploration.

Sandrine Denis-Quanquin , Alessio Bartocci , Florence Szczepaniak , Francois Riobé , Olivier Maury et al.

Physical Chemistry Chemical Physics, 2021, 23 (19), pp.11224-11232. ⟨10.1039/D0CP06570F⟩

Article dans une revue hal-03372877v1
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Recognition of a tandem lesion by DNA bacterial formamidopyrimidine glycosylases explored combining molecular dynamics and machine learning

Emmanuelle Bignon , Natacha Gillet , Chen-Hui Chan , Tao Jiang , Antonio Monari et al.

Computational and Structural Biotechnology Journal, 2021, 19, pp.2861-2869. ⟨10.1016/j.csbj.2021.04.055⟩

Article dans une revue hal-03326585v1
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Influence of divalent cations in the protein crystallization process assisted by lanthanide-based additives

Amandine Roux , Romain Talon , Zaynab Alsalman , Sylvain Engilberge , Anthony d' Aléo et al.

Inorganic Chemistry, 2021, 60 (20), pp.15208-15214. ⟨10.1021/acs.inorgchem.1c01635⟩

Article dans une revue hal-03407486v1
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Low-energy electron transport in gold: mesoscopic potential calculation and its impact on electron emission yields

Ricardo Ramos , Floriane Poignant , Chen-Hui Chan , A. Ipatov , B. Gervais et al.

The European Physical Journal Plus, 2021, 136 (3), pp.345. ⟨10.1140/epjp/s13360-021-01318-x⟩

Article dans une revue hal-03186180v1
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A Dynamic View of the Interaction of Histone Tails with Clustered Abasic Sites in a Nucleosome Core Particle

Emmanuelle Bignon , Natacha Gillet , Tao Jiang , Christophe Morell , Elise Dumont

Journal of Physical Chemistry Letters, 2021, 12 (25), pp.6014-6019. ⟨10.1021/acs.jpclett.1c01058⟩

Article dans une revue hal-03279410v1
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Exploring the Concept of Dimerization-Induced Inter System Crossing: at the Origins of Spin-Orbit Coupling Selection Rules

Laura Abad Galán , José M Andrés Castán , Clément Dalinot , Pablo Simón Marqués , Joachim Galiana et al.

Journal of Physical Chemistry B, 2021, 125 (30), pp.8572-8580. ⟨10.1021/acs.jpcb.1c05082⟩

Article dans une revue hal-03407511v1
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Monte Carlo simulation of free radical production under keV photon irradiation of gold nanoparticle aqueous solution. Part I: Global primary chemical boost

Floriane Poignant , Hela Charfi , Chen-Hui Chan , Elise Dumont , David Loffreda et al.

Radiation Physics and Chemistry, 2020, 172, pp.108790. ⟨10.1016/j.radphyschem.2020.108790⟩

Article dans une revue hal-02498384v1
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Molecular Dynamics Approach for Capturing Calixarenes-Proteins Interactions: The Case of Cytochrome C

Alessio Bartocci , Natacha Gillet , Tao Jiang , Florence Szczepaniak , Elise Dumont

Journal of Physical Chemistry B, 2020, 124 (50), pp.11371-11378. ⟨10.1021/acs.jpcb.0c08482⟩

Article dans une revue hal-03424089v1
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Nucleosomal embedding reshapes the dynamics of abasic sites

Emmanuelle Bignon , Victor Claerbout , Tao Jiang , Christophe Morell , Natacha Gillet et al.

Scientific Reports, 2020, 10 (1), pp.17314. ⟨10.1038/s41598-020-73997-y⟩

Article dans une revue hal-03157466v1
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Polymerization Photoinitiators with Near-Resonance Enhanced Two-Photon Absorption Cross-Section: Toward High-Resolution Photoresist with Improved Sensitivity

Caroline Arnoux , Tatsuki Konishi , Emma van Elslande , Eric-Aimé Poutougnigni , Jean-Christophe Mulatier et al.

Macromolecules, 2020, 53 (21), pp.9264-9278. ⟨10.1021/acs.macromol.0c01518⟩

Article dans une revue hal-03033204v1
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The dark side of disulfide-based dynamic combinatorial chemistry

Benjamin Ourri , Laurent Vial , Mélissa Dumartin , Jean Septavaux , Marion Donnier-Maréchal et al.

Chemical Science, 2020, 11 (31), pp.8151-8156. ⟨10.1039/D0SC02399J⟩

Article dans une revue hal-02995793v1
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Synthesis and Properties of Higher Nuclearity Polyazanes

Thomas Criton , Debora Vilona , Guy Jacob , Maurice Médebielle , Elise Dumont et al.

Chemistry - A European Journal, 2020

Article dans une revue hal-03089670v1
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Impact of the Nucleosome Histone Core on the Structure and Dynamics of DNA-Containing Pyrimidine–Pyrimidone (6–4) Photoproduct

Eva Matoušková , Emmanuelle Bignon , Victor Claerbout , Tomáš Dršata , Natacha Gillet et al.

Journal of Chemical Theory and Computation, 2020, 16 (9), pp.5972-5981. ⟨10.1021/acs.jctc.0c00593⟩

Article dans une revue hal-03157488v1
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Effect of the Ligand Binding Strength on the Morphology of Functionalized Gold Nanoparticles

Chen-Hui Chan , Floriane Poignant , Michael Beuve , Elise Dumont , David Loffreda

Journal of Physical Chemistry Letters, 2020, pp.2717-2723. ⟨10.1021/acs.jpclett.0c00300⟩

Article dans une revue hal-02519412v1
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A Halogen-Bond Donor Catalyst for Templated Macrocyclization

Kevin Guillier , Elsa Caytan , Vincent Dorcet , Florence Mongin , Elise Dumont et al.

Angewandte Chemie International Edition, 2019, 58 (42), pp.14940-14943. ⟨10.1002/anie.201908317⟩

Article dans une revue hal-02303400v1

A biomimetic strategy for the selective recognition of organophosphates in 100% water: synergies of electrostatic interactions, cavity embedment and metal coordination

Solène Collin , Nicolas Giraud , Elise Dumont , Olivia Reinaud

Organic Chemistry Frontiers, 2019, 6 (10), pp.1627-1636. ⟨10.1039/c9qo00263d⟩

Article dans une revue hal-03812803v1
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A Water Solvation Shell Can Transform Gold Metastable Nanoparticles in the Fluxional Regime

Chen-Hui Chan , Floriane Poignant , Michael Beuve , Elise Dumont , David Loffreda

Journal of Physical Chemistry Letters, 2019, 10, pp.1092-1098. ⟨10.1021/acs.jpclett.8b03822⟩

Article dans une revue hal-02057656v1
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Wetting the lock and key enthalpically favours polyelectrolyte binding

Emeric Jeamet , Jean Septavaux , Alexandre Héloin , Marion Donnier-Maréchal , Mélissa Dumartin et al.

Chemical Science, 2019, 10 (1), pp.277-283. ⟨10.1039/c8sc02966k⟩

Article dans une revue hal-01917669v1
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Dynamic Molecular Metamorphism involving Palladium-Assisted Dimerization of π-Cation Radicals

Christophe Kahlfuss , Raymond Grüber , Elise Dumont , Guy Royal , Floris Chevallier et al.

Chemistry - A European Journal, 2019, 25 (6), pp.1573-1580. ⟨10.1002/chem.201805017⟩

Article dans une revue hal-01927373v1
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Photo/Redox-Responsive 2D-Supramolecular Assembly Involving Cucurbit[8]uril and a Star-Shaped Porphyrin Tecton

Shagor Chowdhury , Youssef Nassar , Laure Guy , Denis Frath , Floris Chevallier et al.

Electrochimica Acta, 2019, 316, pp.79-92. ⟨10.1016/j.electacta.2019.05.077⟩

Article dans une revue hal-02146626v1

Probing interaction of a trilysine peptide with DNA behind formation of guanine-lysine cross-links: insights from molecular dynamics.

Chen-Hui Chan , Antonio Monari , Jean-Luc Ravanat , Elise Dumont

Physical Chemistry Chemical Physics, 2019, 21 (42), pp.23418-23424. ⟨10.1039/C9CP04708E⟩

Article dans une revue hal-02311522v1

Unveiling the Binding Modes of the Crystallophore, a Terbium-based Nucleating and Phasing Molecular Agent for Protein Crystallography

Sylvain Engilberge , François Riobé , Tristan Wagner , Sebastiano Di Pietro , Cécile Breyton et al.

Chemistry - A European Journal, 2018, 24 (39), pp.9739-9746. ⟨10.1002/chem.201802172⟩

Article dans une revue hal-01823476v1

Resolving the Singlet Excited State Manifold of Benzophenone by First-Principles Simulations and Ultrafast Spectroscopy

Javier Segarra-Martí , Elena Zvereva , Marco Marazzi , Johanna Brazard , Elise Dumont et al.

Journal of Chemical Theory and Computation, 2018, 14 (5), pp.2570 - 2585. ⟨10.1021/acs.jctc.7b01208⟩

Article dans une revue hal-01889513v1

Diastereoselective Synthesis of a Dyn[3]arene with Distinct Binding Behaviors toward Linear Biogenic Polyamines

Marion Donnier-Marechal , Jean Septavaux , Emeric Jeamet , Alexandre Héloin , Florent Perret et al.

Organic Letters, 2018, 20 (8), pp.2420 - 2423. ⟨10.1021/acs.orglett.8b00766⟩

Article dans une revue hal-01889566v1

The effect of solvent relaxation in the ultrafast time-resolved spectroscopy of solvated benzophenone

Elena Zvereva , Javier Segarra-Martí , Marco Marazzi , Johanna Brazard , Artur Nenov et al.

Photochemical & Photobiological Sciences , 2018, 17 (3), pp.323-331. ⟨10.1039/C7PP00439G⟩

Article dans une revue hal-02184642v1

Dynamics of the excited-state hydrogen transfer in a (dG)·(dC) homopolymer: intrinsic photostability of DNA

Antonio Francés-Monerris , Hugo Gattuso , Daniel Roca-Sanjuán , Iñaki Tuñón , Marco Marazzi et al.

Chemical Science, 2018, 9 (41), pp.7902-7911. ⟨10.1039/c8sc03252a⟩

Article dans une revue hal-01981143v1

Accurate Estimation of the Standard Binding Free Energy of Netropsin with DNA

Hong Zhang , Hugo Gattuso , Elise Dumont , Wensheng Cai , Antonio Monari et al.

Molecules, 2018, 23 (2), pp.228. ⟨10.3390/molecules23020228⟩

Article dans une revue hal-02184614v1
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Ibuprofen and ketoprofen potentiate UVA-induced cell death by a photosensitization process

Emmanuelle Bignon , Marco Marazzi , Vanessa Besancenot , Hugo Gattuso , Guillaume Drouot et al.

Scientific Reports, 2017, 7, pp.8885. ⟨10.1038/s41598-017-09406-8⟩

Article dans une revue hal-01583391v1

Elucidation of the Conformation of Polyglycine Organo-Polyoxotungstates: Evidence for Zipper Folding

Debora Vilona , David Lachkar , Elise Dumont , Moreno Lelli , Emmanuel Lacôte

Chemistry - A European Journal, 2017, 23 (54), pp.13323 - 13327. ⟨10.1002/chem.201703509⟩

Article dans une revue hal-01646338v1
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Interstrand cross-linking implies contrasting structural consequences for DNA: insights from molecular dynamics

Emmanuelle Bignon , Tomáš Dršata , Christophe Morell , Filip Lankaš , Elise Dumont

Nucleic Acids Research, 2017, 45 (4), pp.2188-2195. ⟨10.1093/nar/gkw1253⟩

Article dans une revue hal-01449663v1

Molecular Dynamics Insights into Polyamine-DNA Binding Modes: Implications for Cross-Link Selectivity

Emmanuelle Bignon , Chen-Hui Chan , Christophe Morell , Antonio Monari , Jean-Luc Ravanat et al.

Chemistry - A European Journal, 2017, 23 (52), pp.12845-12852. ⟨10.1002/chem.201702065⟩

Article dans une revue hal-01646327v1
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Conformational polymorphism or structural invariance in DNA photoinduced lesions: implications for repair rates

François Dehez , Hugo Gattuso , Emmanuelle Bignon , Christophe Morell , Elise Dumont et al.

Nucleic Acids Research, 2017, 45 (7), pp.3654-3662. ⟨10.1093/nar/gkx148⟩

Article dans une revue hal-01518937v1

Two-photon-absorption DNA sensitization via solvated electron production: unraveling photochemical pathways by molecular modeling and simulation

Hugo Gattuso , Elise Dumont , Marco Marazzi , Antonio Monari

Physical Chemistry Chemical Physics, 2016, 18 (27), pp.18598 - 18606. ⟨10.1039/c6cp02592g⟩

Article dans une revue hal-01449676v1

Radical-induced purine lesion formation is dependent on DNA helical topology

Michael Terzidis , Andreea Prisecaru , Zara Molphy , Niall Barron , Antonio Randazzo et al.

Free Radical Research, 2016, 50 (sup1), pp.S91 - S101. ⟨10.1080/10715762.2016.1244820⟩

Article dans une revue hal-01896736v1
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Probing the reactivity of singlet oxygen with purines

Elise Dumont , Raymond Grüber , Emmanuelle Bignon , Christophe Morell , Yohann Moreau et al.

Nucleic Acids Research, 2016, 44 (1), pp.56-62. ⟨10.1093/nar/gkv1364⟩

Article dans une revue hal-01271590v1

Hydrogen abstraction by photoexcited benzophenone: consequences for DNA photosensitization

Marco Marazzi , Meilani Wibowo , Hugo Gattuso , Elise Dumont , Daniel Roca-Sanjuan et al.

Physical Chemistry Chemical Physics, 2016, 18 (11), pp.7829-7836. ⟨10.1039/C5CP07938A⟩

Article dans une revue hal-01287926v1

Singlet Oxygen Attack on Guanine: Reactivity and Structural Signature within the B-DNA Helix

Elise Dumont , Raymond Grüber , Emmanuelle Bignon , Christophe Morell , Juan Aranda et al.

Chemistry - A European Journal, 2016, 22 (35), pp.12358-12362. ⟨10.1002/chem.201601287⟩

Article dans une revue istex hal-01449792v1
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Correlation of bistranded clustered abasic DNA lesion processing with structural and dynamic DNA helix distortion

Emmanuelle Bignon , Hugo Gattuso , Christophe Morell , François Dehez , Alexandros G. Georgakilas et al.

Nucleic Acids Research, 2016, 44 (18), pp.8588-8599. ⟨10.1093/nar/gkw773⟩

Article dans une revue hal-01449647v1

Thermodynamics of DNA: sensitizer recognition. Characterizing binding motifs with all-atom simulations

Hugo Gattuso , Elise Dumont , Christophe Chipot , Antonio Monari , François Dehez

Physical Chemistry Chemical Physics, 2016, 18 (48), pp.33180-33186. ⟨10.1039/C6CP06078A⟩

Article dans une revue hal-02186080v1

Repair Rate of Clustered Abasic DNA Lesions by Human Endonuclease: Molecular Bases of Sequence Specificity

Hugo Gattuso , Elodie Durand , Emmanuelle Bignon , Christophe Morell , Alexandros G. Georgakilas et al.

Journal of Physical Chemistry Letters, 2016, 7 (19), pp.3760-3765. ⟨10.1021/acs.jpclett.6b01692⟩

Article dans une revue hal-01449702v1

Electron-Triggered Metamorphism in Porphyrin-Based Self-Assembled Coordination Polymers

Christophe Kahlfuss , Sandrine Denis-Quanquin , Nathalie Calin , Elise Dumont , Marco Garavelli et al.

Journal of the American Chemical Society, 2016, 138 (46), pp.15234 - 15242. ⟨10.1021/jacs.6b09311⟩

Article dans une revue hal-01412979v1

Grafting of Secondary Diolamides onto [P 2 W 15 V 3 O 62 ] 9− Generates Hybrid Heteropoly Acids

David Lachkar , Debora Vilona , Elise Dumont , Moreno Lelli , Emmanuel Lacôte

Angewandte Chemie International Edition, 2016, 55 (20), pp.5961 - 5965. ⟨10.1002/anie.201510954⟩

Article dans une revue istex hal-01889542v1

Editorial: Radiation-induced and oxidative DNA damages

Antonio Monari , Elise Dumont , Chryssostomos Chatgilialoglu

Frontiers in Chemistry, 2015, 3, ⟨10.3389/fchem.2015.00054⟩

Article dans une revue hal-02187408v1

Insights into the chemical meanings of the reaction electronic flux

Christophe Morell , Vincent Tognetti , Emmanuelle Bignon , Elise Dumont , Noemi Hernandez-Haro et al.

Theoretical Chemistry Accounts: Theory, Computation, and Modeling, 2015, 134 (11), pp.133. ⟨10.1007/s00214-015-1730-7⟩

Article dans une revue hal-01363815v1

DFT investigation of the formation of linear aminols as the first step toward the induction of oxidatively generated interstrand cross-link DNA lesions

Raymond Grüber , Élise Dumont

Theoretical Chemistry Accounts: Theory, Computation, and Modeling, 2015, 134 (3), pp.26. ⟨10.1007/s00214-015-1631-9⟩

Article dans une revue hal-01234544v1

Excited state evolution of DNA stacked adenines resolved at the CASPT2//CASSCF/Amber level: from the bright to the excimer state and back

Irene Conti , Artur Nenov , Siegfried Höfinger , Salvatore Flavio Altavilla , Ivan Rivalta et al.

Physical Chemistry Chemical Physics, 2015, 17 (11), pp.7291-7302. ⟨10.1039/c4cp05546b⟩

Article dans une revue hal-01234547v1

Interaction of Palmatine with DNA: An Environmentally Controlled Phototherapy Drug

Élise Dumont , Antonio Monari

Journal of Physical Chemistry B, 2015, 119 (2), pp.410-419. ⟨10.1021/jp5088515⟩

Article dans une revue hal-01114787v1

Probing deactivation pathways of DNA nucleobases by two-dimensional electronic spectroscopy: first principles simulations

Artur Nenov , Javier Segarra-Martí , Angelo Giussani , Irene Conti , Ivan Rivalta et al.

Faraday Discussions, 2015, 177, pp.345-362. ⟨10.1039/c4fd00175c⟩

Article dans une revue hal-01234546v1

Photophysics of Acetophenone Interacting with DNA: Why the Road to Photosensitization is Open

Miquel Huix-Rotllant , Elise Dumont , Nicolas Ferré , Antonio Monari

Journal of Photochemistry and Photobiology, 2015, 91 (2), pp.323-330. ⟨10.1111/php.12395⟩

Article dans une revue istex hal-01234430v1

Optical Properties of Prodigiosin and Obatoclax. Action Spectroscopy and Theoretical Calculations

Evangeline Drink , Elise Dumont , Nils Aronssohn , Philippe Dugourd , Rodolphe Antoine et al.

Physical Chemistry Chemical Physics, 2015, http://pubs.rsc.org/en/content/articlelanding/2015/cp/c5cp01498k#!divAbstract. ⟨10.1039/C5CP01498K⟩

Article dans une revue hal-01160097v1

Insights into the Structure of Intrastrand Cross-Link DNA Lesion-Containing Oligonucleotides: G[8–5m]T and G[8–5]C from Molecular Dynamics Simulations

Elise Dumont , Tomáš Dršata , Célia Fonseca Guerra , Filip Lankaš

Biochemistry, 2015, 54 (5), pp.1259-1267. ⟨10.1021/bi501157v⟩

Article dans une revue hal-01115561v1

Resolving the Benzophenone DNA-Photosensitization Mechanism at QM/MM Level

Elise Dumont , Meilani Wibowo , Daniel Roca-Sanjuán , Marco Garavelli , Xavier Assfeld et al.

Journal of Physical Chemistry Letters, 2015, 6, pp.576-580. ⟨10.1021/jz502562d⟩

Article dans une revue hal-01114786v1

Understanding DNA under oxidative stress and sensitization: the role of molecular modeling

Elise Dumont , Antonio Monari

Frontiers in Chemistry, 2015, 3, pp.43. ⟨10.3389/fchem.2015.00043⟩

Article dans une revue hal-01889534v1

DNA Photosensitization by an "Insider": Photophysics and Triplet Energy Transfer of 5-Methyl-2-pyrimidone Deoxyribonucleoside

Emmanuelle Bignon , Hugo Gattuso , Christophe Morell , Elise Dumont , Antonio Monari

Chemistry - A European Journal, 2015, 21 (32), pp.11509-11516. ⟨10.1002/chem.201501212⟩

Article dans une revue istex hal-01186698v1

Spectral lineshapes in nonlinear electronic spectroscopy

Artur Nenov , Angelo Giussani , Benjamin P. Fingerhut , Ivan Rivalta , Elise Dumont et al.

Physical Chemistry Chemical Physics, 2015, 17 (46), pp.30925-30936. ⟨10.1039/c5cp01167a⟩

Article dans une revue hal-01246263v1

Stability of the Guanine Endoperoxide Intermediate: A Computational Challenge for Density Functional Theory

Raymond Grüber , Antonio Monari , Elise Dumont

Journal of Physical Chemistry B, 2014, 118 (49), pp.11612-11619. ⟨10.1021/jp508330r⟩

Article dans une revue hal-01114788v1

Are Dinucleoside Monophosphates Relevant Models for the Study of DNA Intrastrand Cross-Link Lesions? The Example of G[8–5m]T

Julian Garrec , Elise Dumont

Chemical Research in Toxicology, 2014, 27 (7), pp.1282-1293. ⟨10.1021/tx4004616⟩

Article dans une revue hal-01114965v1

Towards an accurate treatment of σ∗←σ transitions: Moving onto

Élise Dumont , Nicolas Ferré , Antonio Monari

Chemical Physics Letters, 2013, 580, pp.14-20. ⟨10.1016/j.cplett.2013.06.044⟩

Article dans une revue istex hal-01115343v1

What Singles Out the G[8-5]C Intrastrand DNA Cross-Link? Mechanistic and Structural Insights from Quantum Mechanics/Molecular Mechanics Simulations

C. Patel , Julian Garrec , Celine Dupont , E. Dumont

Biochemistry, 2013, 52 (2), pp.425-431. ⟨10.1021/bi301198h⟩

Article dans une revue hal-00828536v1

Addressing the competitive formation of tandem DNA lesions by a nucleobase peroxyl Q1 radical: a DFT-D screening

Celine Dupont , C. Patel , J.-L. Ravanat , E. Dumont

Organic & Biomolecular Chemistry, 2013, 11, pp.3038-3045. ⟨10.1039/c3ob40280k⟩

Article dans une revue hal-00828318v1

A multidimensional approach to the analysis of chemical shift titration experiments in the frame of a multiple reaction scheme

Anthony d'Aléo , Elise Dumont , Olivier Maury , Nicolas Giraud

Magnetic Resonance in Chemistry, 2013, 51 (10), pp.641-648. ⟨10.1002/mrc.3994⟩

Article dans une revue istex hal-01115341v1

Exploration of the supramolecular interactions involving tris-dipicolinate lanthanide complexes in protein crystals by a combined biostructural, computational and NMR study.

Elise Dumont , Guillaume Pompidor , Anthony d'Aléo , Jean Vicat , Loic Toupet et al.

Physical Chemistry Chemical Physics, 2013, 15 (41), pp.18235-42. ⟨10.1039/c3cp53671h⟩

Article dans une revue hal-01326128v1

Superior Performance of Range-Separated Hybrid Functionals for Describing σ* ← σ UV-Vis Signatures of Three-Electron Two-Center Anions

Céline Dupont , Elise Dumont , Denis Jacquemin

Journal of Physical Chemistry A, 2012, 116 (12), pp.3237-3246. ⟨10.1021/jp211875r⟩

Article dans une revue hal-00865317v1

One-electron addition on short-loop selenylsulfide and diselenide-linked biomolecules: From diethyldichalcogens to Grx3-like selenopeptides

Elise Dumont

International Journal of Quantum Chemistry Symposium, 2012, 112 (8), pp.2018-2029. ⟨10.1002/qua.23233⟩

Article dans une revue istex hal-01115359v1

Insights into Intrastrand Cross-Link Lesions of DNA from QM/MM Molecular Dynamics Simulations

Julian Garrec , Chandan Patel , Ursula Rothlisberger , Elise Dumont

Journal of the American Chemical Society, 2012, 134 (4), pp.2111-2119. ⟨10.1021/ja2084042⟩

Article dans une revue hal-01115345v1

Geometrical Embedding Governs a Dramatic Variation of Electron Paramagnetic Resonance Hyperfine Coupling Constants of Disulfide Radical Anions

Élise Dumont , Nicolas Ferré

Journal of Physical Chemistry B, 2011, 115 (20), pp.6776-6783. ⟨10.1021/jp2021566⟩

Article dans une revue hal-01104310v1

Burrowing and subsurface locomotion in anguilliform fish: behavioral specializations and mechanical constraints

A. Herrel , H. Choi , E. Dumont , N. de Schepper , B. Vanhooydonck et al.

Journal of Experimental Biology, 2011, 214 (8), pp.1379-1385. ⟨10.1242/jeb.051185⟩

Article dans une revue hal-02436092v1

Unraveling Gold(I)-Specific Action Towards Peptidic Disulfide Cleavage: A DFT Investigation

Elise Dumont , Carine Michel , Philippe Sautet

ChemPhysChem, 2011, 12 (14), pp.2596-2603. ⟨10.1002/cphc.201100336⟩

Article dans une revue istex hal-01121423v1

Performances of recently-proposed functionals for describing disulfide radical anions and similar systems

Élise Dumont , Adele D. Laurent , Xavier Assfeld , Denis Jacquemin

Chemical Physics Letters, 2011, 501 (4-6), pp.245-251. ⟨10.1016/j.cplett.2010.11.062⟩

Article dans une revue istex hal-01116173v1

Improved DFT Description of Intrastrand Cross-Link Formation by Inclusion of London Dispersion Corrections

Céline Dupont , Chandan Patel , Elise Dumont

Journal of Physical Chemistry B, 2011, 115 (50), pp.15138-15144. ⟨10.1021/jp209074q⟩

Article dans une revue hal-01115361v1

Electronic effects and ring strain influences on the electron uptake by selenium-containing bonds

Elise Dumont , Pierre-Francois Loos , Adele D. Laurent , Xavier Assfeld

International Journal of Quantum Chemistry Symposium, 2010, 110 (3), pp.513-523. ⟨10.1002/qua.22072⟩

Article dans une revue istex hal-01116181v1

Intersulfur Distance Is a Key Factor in Tuning Disulfide Radical Anion Vertical UV−Visible Absorption

Elise Dumont , Adele D. Laurent , Xavier Assfeld

Journal of Physical Chemistry Letters, 2010, 1 (2), pp.581-586. ⟨10.1021/jz900214e⟩

Article dans une revue hal-01116178v1

Built to bite: cranial design and function in the wrinkle-faced bat

E. Dumont , A. Herrel , R. Medellã­n , J. Vargas-Contreras , S. Santana

Australian Journal of Zoology, 2009, 279 (4), pp.329-337. ⟨10.1111/j.1469-7998.2009.00618.x⟩

Article dans une revue istex hal-02435662v1

How does microhydration impact on structure, spectroscopy and formation of disulfide radical anions? An ab initio investigation on dimethyldisulfide

Inacrist Geronimo , Nicolas Chéron , Paul Fleurat-Lessard , Élise Dumont

Chemical Physics Letters, 2009, 481 (4-6), pp.173-179. ⟨10.1016/j.cplett.2009.09.079⟩

Article dans une revue istex hal-01116184v1

Analyzing the Selectivity and Successiveness of a Two-Electron Capture on a Multiply Disulfide-Linked Protein

Élise Dumont , Adele D. Laurent , Pierre-François Loos , Xavier Assfeld

Journal of Chemical Theory and Computation, 2009, 5 (6), pp.1700-1708. ⟨10.1021/ct900093h⟩

Article dans une revue hal-01116191v1

Important effects of neighbouring nucleotides on electron induced DNA single-strand breaks

Pierre-François Loos , Elise Dumont , Adele D. Laurent , Xavier Assfeld

Chemical Physics Letters, 2009, 475 (1-3), pp.120-123. ⟨10.1016/j.cplett.2009.05.041⟩

Article dans une revue istex hal-01116187v1

Factors Governing Electron Capture by Small Disulfide Loops in Two-Cysteine Peptides

Élise Dumont , Pierre-François Loos , Xavier Assfeld

Journal of Physical Chemistry B, 2008, 112 (43), pp.13661-13669. ⟨10.1021/jp806465e⟩

Article dans une revue istex hal-01116240v1

Huge Disulfide-Linkage’S Electron Capture Variation Induced by α-Helix Orientation

Elise Dumont , Pierre-François Loos , Adele D. Laurent , Xavier Assfeld

Journal of Chemical Theory and Computation, 2008, 4 (8), pp.1171-1173. ⟨10.1021/ct800161m⟩

Article dans une revue hal-01116239v1

DNA-Histone Cross-link Formation Via Hole Trapping in Nucleosome Core Particles

Maxime Kermarrec , Elise Dumont , Natacha Gillet

International Society of Quantum Biology and Pharmacology (ISQBP) 2024 President’s Meeting., May 2024, Athènes, Greece

Communication dans un congrès hal-04724417v1

DNA-Histone cross-link formation via Hole Trapping in Nucleosome core particle

Natacha Gillet , Maxime Kermarrec , Elise Dumont

MoThS, May 2024, Pont-à-Mousson (France), France

Communication dans un congrès hal-04727351v1

DNA-Histone Cross-link Formation Via Hole Trapping in Nucleosome Core Particles

Maxime Kermarrec , Elise Dumont , Natacha Gillet

Journée scientifique du Pôle Sud-Est de ThéMoSia 2023, 2023, Lyon, France

Communication dans un congrès hal-04724399v1

Mapping Guanine Oxidation in Nucleosomal DNA using Multiscale Simulations

Natacha Gillet , Maxime Kermarrec , Elise Dumont

ABC2023, Apr 2023, Ascona, Switzerland

Communication dans un congrès hal-04727458v1

DNA-Histone Cross-link Formation Via Hole Trapping in Nucleosome Core Particles

Maxime Kermarrec , Elise Dumont , Natacha Gillet

20 th Congress of the European Society for Photobiology 2023, Aug 2023, Lyon, France

Communication dans un congrès hal-04724407v1

Electron-Triggered Spin State Switching in a Viologen-Substituted Nickel Porphyrin

Shaymaa Al Shehimy , Orsola Baydoun , Elise Dumont , Denis Frath , Floris Chevallier et al.

International Conference on   Porphyrins and Phthalocyanines (ICPP), Jul 2022, Madrid, Spain

Communication dans un congrès hal-03870587v1

Electron-Triggered Metamorphism Applied to Spin-State Switching

Christophe Bucher , Shaymaa Al Shehimy , Orsola Baydoun , Elise Dumont , Denis Frath et al.

73rd Annual Meeting of the International Society of Electrochemistry, Sep 2022, Online Meeting, China

Communication dans un congrès hal-03870627v1

Photoinduced Electron Transfer as a Trigger for Molecular and Supramolecular Metamorphism

Shagor Chowdhury , Christophe Kahlfuss , Vivien Andrieux , Clément Roizard , Shaymaa Al Shehimy et al.

6th International Workshops on Nano and Bio-Photonics (IWNBP), Sep 2022, Evian, France

Communication dans un congrès hal-03828307v1

Electron-Triggered Metamorphism in Metal-Organic Architectures, From Responsive Self-Assembled Materials to Spin-State Switching

Shaymaa Al Shehimy , Orsola Baydoun , Elise Dumont , Denis Frath , Floris Chevallier et al.

Journées annuelles du groupe Français de Magnétisme Moléculaire, Nov 2022, Dourdan, France

Communication dans un congrès hal-04889298v1

Electron-Triggered Metamorphism in Metal-Organic Architectures : From Responsive Self-Assembled Materials to Spin-State Switching

Shaymaa Al Shehimy , Orsola Baydoun , Elise Dumont , Denis Frath , Floris Chevallier et al.

journées scientifiques de l’Association Française de Magnétisme Moléculaire JAM2 2022, Nov 2022, Dourdan, France

Communication dans un congrès hal-03870642v1

Mapping Guanine Oxidation in Nucleosomal DNA using Multiscale Simulations

Natacha Gillet , Laleh Allahkaram , Maxime Kermarrec , Elise Dumont

ESPA 2022, Jun 2022, Vigo, Spain

Communication dans un congrès hal-04727520v1

Mapping Guanine Oxidation in Nucleosomal DNA using Multiscale Simulations

Natacha Gillet , Laleh Allahkaram , Maxime Kermarrec , Elise Dumont

ISQBP President’s meeting 2022, Jul 2022, Innsbruck, Austria

Communication dans un congrès hal-04727507v1

Coordination-induced Spin State Switching in Redox-responsive Viologen-based Metalloporphyrins

Shaymaa Al-Shehimy , Elise Dumont , Denis Frath , Floris Chevallier , Christophe Bucher

journée Scientifiques du GDR MAPYRO (Macrocycles Pyrroliques), May 2021, web meeting, France

Communication dans un congrès hal-03435816v1

Towards Electron-triggered Coordination-induced Spin State Switching in Viologen-based Metal Complexes

Shaymaa Al-Shehimy , Lhoussain Khrouz , Elise Dumont , Denis Frath , Floris Chevallier et al.

Gecom-Concoord Webinaire, Jul 2021, Webinaire, France

Communication dans un congrès hal-03441972v1

Viologen π-Dimerization as a Trigger for Metamorphism in Supramolecular Stimuli-Responsive Materials

Denis Frath , Thomas Gibaud , Shagor Chowdhury , Christophe Kahlfuss , Clément Roizard et al.

The 6th Edition of the Smart Materials and Surfaces - SMS 2021 Conference, Oct 2021, Milan, Italy

Communication dans un congrès hal-03421044v1

Towards Electron-triggered Coordination-induced Spin State Switching in Viologen-based Metal Complexes

Shaymaa Al-Shehimy , Lhoussain Khrouz , Elise Dumont , Denis Frath , Floris Chevallier et al.

Journée du Groupement d'Etude en Recherche PhotoElectroStimulation, Oct 2021, Paris-Saclay, France

Communication dans un congrès hal-03441946v1

Electron-Triggered Metamorphism in Adaptative Supramolecular Polymers

Christophe Kahlfuss , Elise Dumont , Eric Saint-Aman , Youssef Nassar , Shaymaa Al-Shehimy et al.

Current Trends in Electrochemistry; First French-Spanish Worshop on Electrochemistry-, Jun 2021, Paris, France

Communication dans un congrès hal-03435811v1

Towards Electron-triggered Coordination-induced Spin State Switching in Viologen-based Metal Complexes

Shaymaa Al-Shehimy , Elise Dumont , Denis Frath , Floris Chevallier , Christophe Bucher

Journée Webinaire de la section Rhône-Alpes de la Société Chimique de France, Jan 2021, Webinaire, France

Communication dans un congrès hal-03441965v1

Electron-Triggered Metamorphism in Porphyrin-Based Self-Assembled Supramolecular Polymers

Christophe Bucher , Shagor Chowdhury , Christophe Kahlfuss , Youssef Nassar , Shaymaa Al-Shehimy et al.

239th ECS Meeting, May 2021, Chicago, France

Communication dans un congrès hal-03435824v1

Stimuli-Responsive Supramolecular Assembly Involving Cucurbit[8]uril and Porphyrin-based Tectons

Shagor Chowdhury , Laure Guy , Denis Frath , Floris Chevallier , Elise Dumont et al.

IIèmes Journées annuelles du GDR Photo & Electro Stimulation, Jan 2020, Angers, France

Communication dans un congrès hal-03033577v1

Computational insights into DNA lesions: sequence effects in and out of the nucleosome

Emmanuelle Bignon , Elise Dumont

Network analysis to elucidate natural system dynamics, diversity and performance - CECAM workshop, May 2019, Lyon, France

Communication dans un congrès hal-02308301v1

Dynamic Molecular Metamorphism involving Palladium-Assisted Dimerization of π-Cation Radicals

Shagor Chowdhury , Christophe Kahlfuss , Denis Frath , Floris Chevallier , Elise Dumont et al.

GECOM CONCOORD 2019, May 2019, Erquy, France

Communication dans un congrès hal-03033484v1

Molecular dynamics insights for DNA lesions in oligonucleotides and nucleosomal DNA

Emmanuelle Bignon , Elise Dumont

Huitième réunion annuelle du GdR Architecture et Dynamique Nucléaires (ADN), Mar 2019, Lyon, France

Communication dans un congrès hal-02124544v1

Photo/Redox-Responsive Supramolecular Assemblies Involving Cucurbit[n]uril cavitands and Porphyrin-based Tectons

C. Bucher , Shagor Chowdhury , Youssef Nassar , Grégoire Jean-François Demets , Elise Dumont et al.

Journées scientifiques communes des GDR PES (photo-electrostimulation) et MCM2 (magnétisme et commutation moléculaire), Jun 2019, Lille, France

Communication dans un congrès hal-04887034v1

Mapping DNA lesions in and out the nucleosome: insights from molecular dynamics simulations

Elise Dumont

3rd Workshop on DNA Damage and Repair (DNADNR): Chemistry, Biology, and Medicine, Sep 2019, Valencia, Spain

Communication dans un congrès hal-02308329v1

Structure and reactivity of complex DNA lesions: clustered abasic sites as a case study

Emmanuelle Bignon , Christophe Morell , Elise Dumont

21e congrès du GGMM, Apr 2019, Nice, France

Communication dans un congrès hal-02308222v1

Stimulus-Triggered Metamorphism in Self-Assembled Metal-Organic Architectures

Christophe Kahlfuss , Élise Dumont , Eric Saint-Aman , Youssef Nassar , Shagor Chowdhury et al.

5th International Workshop on Nano and Bio-Photonics (IWNBP), Sep 2019, Saint-Nectaire, France

Communication dans un congrès hal-04887001v1

Photo/Redox Control of π-Dimerization as a Trigger for Molecular and Supramolecular Metamorphism

Denis Frath , Thomas Gibaud , Clément Roizard , Shagor Chowdhury , Youssef Nassar et al.

NanoSynergetics Workshop - 9th International Symposium On Photochromism (ISOP), Sep 2019, Paris, France

Communication dans un congrès hal-02301752v1

QM/MM investigations of DNA lesions: what can we learn so far ?

Elise Dumont

19th deMon developers workshop, May 2019, Fréjus, France

Communication dans un congrès hal-02308256v1

Mapping DNA-Photosensitizers Interaction In and Out the Nucleosome

Elise Dumont

Molecular and materials simulation at the turn of the decade: celebrating 50 years of CECAM, Sep 2019, Lausanne, Switzerland

Communication dans un congrès hal-02308281v1

Theoretical Study of Hydrated Gold Nanoparticles for Radiotherapy Applications

Chen-Hui Chan , Elise Dumont , David Loffreda

Colloque du GDR SOLVATE, Feb 2019, Lyon, France

Communication dans un congrès hal-02120241v1

Probing the mechanistic pathways and structural aftermaths of complex DNA lesions

Elise Dumont

BIO2018 Congress and 51st Meeting of the Polish Biochemical Society, Sep 2018, Gdansk, Poland

Communication dans un congrès hal-02061517v1

Dynamique des lésions de l'ADN

Elise Dumont

XVIèmes Rencontres des Chimistes Théoriciens Francophones, Oct 2018, Toulouse, France

Communication dans un congrès hal-02061604v1

Theoretical Study of Hydrated Gold Nanoparticles for Radiotherapy Applications

Chen-Hui Chan , Elise Dumont , David Loffreda

Colloque du GDR NanOperando, Nov 2018, Lyon, France

Communication dans un congrès hal-02120238v1

Theoretical Study of Hydrated Gold Nanoparticles for Radiotherapy Applications

Chen-Hui Chan , Elise Dumont , David Loffreda

DocScilor, Jun 2017, Nancy,, France

Communication dans un congrès hal-02120243v1

Molecular dynamics investigation of DNA tandem lesions repair

Elise Dumont

FemEx 2017, Jun 2017, Putten, Netherlands

Communication dans un congrès hal-01726406v1

Modelling the structure and triplet-triplet energy transfer of the 6-4 photoproduct

Emmanuelle Bignon , Hugo Gattuso , Christophe Morell , Antonio Monari , Elise Dumont

Joint Congress of the French and Italian Photochemists and Photobiologists 2016, Sep 2016, Bari, Italy

Communication dans un congrès hal-01488339v1

Modélisation de structures d'ADN endommagé : un microscope computationnel

Emmanuelle Bignon , Raymond Grüber , Elise Dumont , Christophe Morell , Jean-Luc Ravanat

Forum de la recherche en cancérologie Rhône-Alpes Auvergne, Mar 2016, Lyon, France

Communication dans un congrès hal-01297487v1

MODELLING THE INTERSTRAND CROSS-LINKS IMPACT ON DNA STRUCTURE

Emmanuelle Bignon , Tomáš Dršata , Elise Dumont , Christophe Morell , Filip Lankaš

14th International Workshop on Radiation Damage to DNA, Mar 2016, Melbourne, Australia

Communication dans un congrès hal-01490046v1

Probing the reactivity underpinning DNA lesions by multiscale simulations

Elise Dumont

14th International Workshop on Radiation Damage to DNA, Mar 2016, Melbourne, Australia

Communication dans un congrès hal-01490041v1

Abasic Sites Impact on DNA Structure and Interstrand Cross-Links Generation Modelling

Emmanuelle Bignon , Christophe Morell , Elise Dumont

COST Action CM1201 : Biomimetic Radical Chemistry & ClicGene , Mar 2016, Grenoble, France

Communication dans un congrès hal-01490054v1

Multi-scale simulations of complex oxidatively-generated DNA lesions: reactivity and structure.

Elise Dumont , Chandan Patel , Julian Garrec

9th Congress on Electronic Structure: Principles and Applications (ESPA), Jul 2014, Badajoz, Spain

Communication dans un congrès hal-02061507v1
Deposit thumbnail

DNA Photodamage and Repair: Computational Photobiology in Action

Antonio Francés-Monerris , Natacha Gillet , Elise Dumont , Antonio Monari

QM/MM Studies of Light-responsive Biological Systems, 31, Springer International Publishing, pp.293-332, 2020, Challenges and Advances in Computational Chemistry and Physics, ⟨10.1007/978-3-030-57721-6_7⟩

Chapitre d'ouvrage hal-03424121v1