Bruno Cardey Maître de Conférences en chimie numérique à l'Université de Franche-Comté (Besançon, France)

Identifiants chercheurs

IdHAL :

bruno-cardey

ORCID :

0000-0001-7420-6894

Publications

Pré-publication, Document de travail (1)

Numérique écoresponsable : adoptons quelques bonnes pratiques (Poster réalisé dans le cadre du Digital Cleanup Day 2025, Besançon) Romain Borne,Bruno Cardey,Charles-henri Falconnet,Estelle Franc,Françoise Immelet al. 2025 Pré-publication, Document de travail hal-05085773v1

Chapitre d'ouvrage (1)

Negative impact of citral on susceptibility of Pseudomonas aeruginosa to antibiotics. Alexandre Tetard,Sarah Foley,Gaetan L. A. Mislin,Jean Michel Brunel,Estefania Olivaet al. Prime Archives in Microbiology: 3rd Edition; 2023, Aalaa Mahgoub Albasha, In press Chapitre d'ouvrage hal-04269786v1

Article dans une revue (22)

Effect of the water coverage on the interaction of O$_2$ and H$_2$ with the Na-LTA zeolite by first-principles simulations Joharimanitra Randrianandraina,Michael Badawi,Christophe Ramseyer,Bruno Cardey,Jean-Emmanuel Groetzet al. Inorganic Chemistry Frontiers, 2023, 10 (2), pp.383-395. ⟨10.1039/d2qi01280d⟩ Article dans une revue hal-04226791v1
Adsorption Study of Main Gas Products from Water Radiolysis on 4A Zeolite by Numerical Simulations Joharimanitra Randrianandraina,Manuel Grivet,Christophe Ramseyer,Jean-Emmanuel Groetz,Bruno Cardeyet al. Fusion Science and Technology, 2021, 77 (1), pp.19-25. ⟨10.1080/15361055.2020.1842680⟩ Article dans une revue hal-03136472v1
Vers une compréhension fine du devenir de l'eau tritiée adsorbée sur zéolithe. Caroline Chambelland,Didier Ducret,Joharimanitra Randrianandraina,Manuel Grivet,Christophe Ramseyeret al. Chocs, 2021, 15 Article dans une revue hal-03474999v1
L’eau tritiée fait sa propre radiolyse Caroline Chambelland,Manuel Grivet,Joharimanitra Randrianandraina,Christophe Ramseyer,Jean-Emmanuel Groetzet al. L'Actualité Chimique, 2021, La chimie sous rayonnement, 460-461 Article dans une revue hal-03474987v1
Negative Impact of Citral on Susceptibility of Pseudomonas aeruginosa to Antibiotics Alexandre Tetard,Sarah Foley,Gaëtan Mislin,Jean-Michel Brunel,Estefania Olivaet al. Frontiers in Microbiology, 2021, 12, pp.709838. ⟨10.3389/fmicb.2021.709838⟩ Article dans une revue hal-03371084v1
Adsorption of water in Na-LTA zeolites: an ab initio molecular dynamics investigation Joharimanitra Randrianandraina,Michael Badawi,Bruno Cardey,Manuel Grivet,Jean-Emmanuel Groetzet al. Physical Chemistry Chemical Physics, 2021, 23 (34), pp.19032-19042. ⟨10.1039/D1CP02624K⟩ Article dans une revue hal-03474915v1
Synthesis, evaluation and molecular modelling of piceatannol analogues as arginase inhibitors J. Muller,B. Cardey,A. Zedet,C. Desingle,M. Grzybowskiet al. RSC Medicinal Chemistry, 2020, 11 (5), pp.559-568. ⟨10.1039/D0MD00011F⟩ Article dans une revue hal-03409106v1
Fate of cisplatin and its main hydrolysed forms in the presence of thiolates: a comprehensive computational and experimental study Thibault Minervini,Bruno Cardey,Sarah Foley,Christophe Ramseyer,Mironel Enescu Metallomics, 2019, 11 (4), pp.833-844. ⟨10.1039/c8mt00371h⟩ Article dans une revue hal-04227810v1
Methionine oxidation by hydrogen peroxide in peptides and proteins: A theoretical and Raman spectroscopy study Michel Fromm,Béatrice Sjöberg,Sarah Foley,Bruno Cardey,Mironel Enescu Journal of Photochemistry and Photobiology B: Biology, 2018, 188, pp.95-99. ⟨10.1016/j.jphotobiol.2018.09.009⟩ Article dans une revue hal-03558167v1
Squalene versus cholesterol: Which is the best nanocarrier for the delivery to cells of the anticancer drug gemcitabine? Arnaud Peramo,Simona Mura,Semen Yesylevskyy,Bruno Cardey,Dunja Sobotet al. Comptes Rendus. Chimie, 2018, 21 (10), pp.974-986. ⟨10.1016/j.crci.2018.02.008⟩ Article dans une revue hal-02349745v1
Methionine oxidation by hydrogen peroxide in peptides and proteins: A theoretical and Raman spectroscopy study Béatrice Sjöberg,Sarah Foley,Bruno Cardey,Michel Fromm,Mironel Enescu Journal of Photochemistry and Photobiology B: Biology, 2018, 188, pp.95-99. ⟨10.1016/j.jphotobiol.2018.09.009⟩ Article dans une revue hal-03526830v1
Empirical force field for cisplatin based on quantum dynamics data: case study of new parameterization scheme for coordination compounds S. Yesylevskyy,Bruno Cardey,Sebastian Kraszewski,Sarah Foley,Mironel Enescuet al. Journal of Molecular Modeling, 2015, 21 (10), pp.268. ⟨10.1007/s00894-015-2812-0⟩ Article dans une revue hal-01292958v1
Theoretical insights into the mechanism of redox switch in heat shock protein Hsp33 Mironel Enescu,Rima Kassim,Christophe Ramseyer,Bruno Cardey Journal of Biological Inorganic Chemistry, 2015, 20 (3), pp.555-562. ⟨10.1007/s00775-015-1240-z⟩ Article dans une revue hal-04227828v1
Empirical force field for cisplatin based on quantum dynamics data: case study of new parameterization scheme for coordination compounds S. Yesylevskyy,Bruno Cardey,S. Kraszewski,Sarah Foley,Mironel Enescuet al. Journal of Molecular Modeling, 2015, 21 (10), pp.268. ⟨10.1007/s00894-015-2812-0⟩ Article dans une revue hal-04227822v1
Theoretical insights into the mechanism of redox switch in heat shock protein Hsp33 Mironel Enescu,Rima Kassim,Christophe Ramseyer,Bruno Cardey Journal of Biological Inorganic Chemistry, 2015, 3, pp.555-562. ⟨10.1007/s00775-015-1240-z⟩ Article dans une revue hal-01114824v1
An experimental and theoretical study of the amino acid side chain Raman bands in proteins Sjöberg Béatrice,Sarah Foley,Bruno Cardey,Mironel Enescu Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy [1994-..], 2014, 128, pp.300-311. ⟨10.1016/j.saa.2014.02.080⟩ Article dans une revue istex hal-01064190v1
Hemoglobin as a Nitrite Anhydrase: Modeling Methemoglobin ‐ Mediated N 2 O 3 Formation Bruno Cardey,Kathrin Hopmann,Mark Gladwin,Daniel Kim‐shapiro,Abhik Ghosh Chemistry - A European Journal, 2011, 17 (23), pp.6348-6358. ⟨10.1002/chem.201003578⟩ Article dans une revue hal-03526841v1
Cysteine oxidation by the superoxide radical: a theoretical study Bruno Cardey,Mironel Enescu ChemPhysChem, 2009, 10 (9-10), pp.1642-1648. ⟨10.1002/cphc.200900010⟩ Article dans une revue hal-00663222v1
Mechanism of thiol oxidation by the superoxide radical Bruno Cardey,Sarah Foley,Mironel Enescu Journal of Physical Chemistry A, 2007, 111 (50), pp 13046-13052. ⟨10.1021/jp0731102⟩ Article dans une revue istex hal-00675149v1
Selenocysteine versus Cysteine Reactivity : a Theoretical Study of their Oxidation by the Hydrogen Peroxide Mironel Enescu,Bruno Cardey Journal of Physical Chemistry A, 2007, 111 (4), pp.673-678. ⟨10.1021/jp0658445⟩ Article dans une revue istex hal-00675196v1
Mechanism of cysteine oxidation by hydroxyl radical: a theoretical study Mironel Enescu,Bruno Cardey ChemPhysChem, 2006, 7 (4), pp.912-919. ⟨10.1002/cphc.200500585⟩ Article dans une revue hal-00675201v1
A computational study of thiolate and selenolate oxidation by hydrogen peroxide Bruno Cardey,Mironel Enescu ChemPhysChem, 2005, 6, pp.1175-1180. ⟨10.1002/cphc.200400568⟩ Article dans une revue istex hal-00675204v1