Numerical simulation studies of the structural dynamics of nuclear receptors

Publications

• 2022

  • 1-Hydroxy-2(1H)-pyridinone-Based Chelators with Potential Catechol O-Methyl Transferase Inhibition and Neurorescue Dual Action against Parkinson’s Disease

    • Joseph C J Bergin
    • Kean Kan Tan
    • Anya K Nelson
    • Cristina-Andreea Amarandei
    • Véronique Hubscher-Bruder
    • Jérémy Brandel
    • Varvara Voinarovska
    • Annick Dejaegere
    • Roland H Stote
    • David Tétard

    Molecules ; Volume: 27 ; Page: 2816

    HAL DOI

  • Agonistic and potentiating effects of perfluoroalkyl substances (PFAS) on the Atlantic cod (Gadus morhua) peroxisome proliferator-activated receptors (Ppars)

    • Sofie Søderstrøm
    • Roger Lille-Langøy
    • Fekadu Yadetie
    • Mateusz Rauch
    • Ana Milinski
    • Annick Dejaegere
    • Roland Stote
    • Anders Goksøyr
    • Odd André Karlsen

    Environment International ; Volume: 163 ; Page: 107203

    HAL DOI

• 2018

  • Post-translational modifications in DNA topoisomerase 2α highlight the role of a eukaryote-specific residue in the ATPase domain

    • Claire Bedez
    • Christophe Lotz
    • Claire Batisse
    • Arnaud Vanden Broeck
    • Roland Stote
    • Eduardo Howard
    • Karine Pradeau Aubreton
    • Marc Ruff
    • Valerie Lamour

    Scientific Reports ; Volume: 8

    HAL DOI

• 2017

  • Allosteric Regulation in the Ligand Binding Domain of Retinoic Acid Receptorγ

    • Yassmine Chebaro
    • Serena Sirigu
    • Ismail Amal
    • Régis Lutzing
    • Roland Stote
    • Cécile Rochette-Egly
    • Natacha Rochel
    • Annick Dejaegere

    PLoS ONE ; Volume: 12 ; Page: e0171043

    HAL DOI

  • Peptide-Protein Binding Investigated by Far-IR Spectroscopy and Molecular Dynamics Simulations

    • Yoann Cote
    • Yves Nominé
    • Juan Ramon Ramirez Ramos
    • Petra Hellwig
    • Roland Stote

    Biophysical Journal ; Volume: 112 ; Page: 2575-2588

    HAL DOI

• 2016

  • Tautomers of a Fluorescent G Surrogate and Their Distinct Photophysics Provide Additional Information Channels

    • Marianna Sholokh
    • Roberto Improta
    • Mattia Mori
    • Rajhans Sharma
    • Cyril Kenfack
    • Dongwon Shin
    • Karine Voltz
    • Roland Stote
    • Olga A. Zaporozhets
    • Maurizio Botta
    • Yitzhak Tor
    • Yves Mély

    Angewandte Chemie International Edition ; Volume: 55 ; Page: 7974-8

    HAL DOI

  • Quantitative sampling of conformational heterogeneity of a DNA hairpin using molecular dynamics simulations and ultrafast fluorescence spectroscopy

    • Karine Voltz
    • Jérémie Léonard
    • Patricia Touceda
    • Jamie Conyard
    • Ziyad Chaker
    • Annick Dejaegere-Stote
    • Julien Godet
    • Yves Mely
    • Stefan Haacke
    • Roland Stote

    Nucleic Acids Research ; Volume: 44 ; Page: 3408-3419

    HAL DOI