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    • Elise Dumont

    8 results in Authors: Elise Dumont

    Category: Physical Chemistry
    ,
    Working Paper
    , Title:

    The behavior of triplet thymine in a model B-DNA strand. Energetics and spin density localization revealed by ab initio molecular dynamics simulations.

    , Authors: Laleh Allahkaram, Antonio MONARI, Elise Dumont

    131
    Downloads
    Category: Theoretical and Computational Chemistry
    ,
    Working Paper
    , Title:

    Assessing the Sequence Dependence of Pyrimidine-Pyrimidone (6-4) Photoproduct in a Duplex Double-Stranded DNA: A Challenge for Microsecond Range Simulation

    , Authors: Natacha Gillet, Alessio Bartocci, Elise Dumont

    295
    Downloads
    Category: Physical Chemistry
    ,
    Working Paper
    , Title:

    Capturing The Dynamic Association Between A Tris-Dipicolinate Lanthanide Complex And A Decapeptide: A Combined Paramagnetic NMR And Molecular Dynamics Exploration.

    , Authors: Sandrine Denis-Quanquin, Alessio Bartocci, florence szczepaniak, François Riobé, Olivier MAURY, Elise Dumont, nicolas giraud

    284
    Downloads
    Category: Physical Chemistry
    ,
    Working Paper
    , Title:

    Polymerization Photoinitiators with Near-Resonance Enhanced Two-Photon Absorption Cross-Section: Towards High-Resolution Photoresists with Improved Sensitivity

    , Authors: Caroline Arnoux, tatsuki konishi, Emma Van Elslande, Eric Aymé Poutougnigni, jean-christophe Mulatier, Lhoussain Khrouz, Christophe Bucher, Elise Dumont, Kenji Kamada, Chantal Andraud, Patrice L. Baldeck, Ákos Bányász, Cyrille Monnereau

    526
    Downloads
    Category: Inorganic Chemistry
    ,
    Working Paper
    , Title:

    Influence of divalent cations in the protein crystallization process assisted by Lanthanide-based additives.

    , Authors: Olivier Maury, Romain Talon, Zaynab Alsalman, Sylvain Engilberge, Eric Girard, Anthony D'Aléo, Amandine Roux, Sebastiano Di Pietro, Adeline Robin, Alessio Bartocci, Guillaume Pilet, Elise Dumont, Tristan Wagner, Seigo Shima, François Riobé

    216
    Downloads
    Category: Organic Chemistry
    ,
    Working Paper
    , Title:

    Encoding stereochemical molecular information on cyclophanes using non-directional interactions and achiral building blocks

    , Authors: Yuan Zhang, Benjamin Ourri, Pierre-Thomas Skowron, Emeric Jeamet, Ana Belenguer, nicolas Vanthuyne, olivier cala, Pradeep Mandal, Christian Duchamp, Elise Dumont, Florent Perret, Laurent Vial, Ivan Huc, Julien Leclaire

    257
    Downloads
    Category: Theoretical and Computational Chemistry
    ,
    Working Paper
    , Title:

    Molecular dynamics approach for capturing calixarenes--proteins interactions: the case of cytochrome c

    , Authors: Alessio Bartocci, florence szczepaniak, Tao Jiang, Natacha Gillet, Elise Dumont

    740
    Downloads
    Category: Theoretical and Computational Chemistry
    ,
    Working Paper
    , Title:

    Capturing the recognition dynamics of para-sulfonato- calix[4]arenes by cytochrome c: towards a quantitative free energy assessment

    , Authors: Alessio Bartocci, Gilberto Pereira, Marco Cecchini, Elise Dumont

    144
    Downloads