Browsing Faculté des arts et des sciences – Département de physique - Travaux et publications by Subject "Molecular dynamics"

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  • Insights on the effect of water content in carburizing gas mixtures on the metal dusting corrosion of iron 

    Bentria, El Tayeb; Salawu, Omotayo Akande; Ramesh, Abitha; Laycock, Nicholas; Hamer, Wouter; Mousseau, Normand; Becquart, Charlotte; Bouhali, Othmane; El-Mellouhi, Fedwa (Elsevier, 2021-12-07)
    Constituents of syngas, such as water, carbon monoxide and sulfides, can cause the degradation of the steel pipes they move through, leading to carbon dusting and corrosion. In spite of considerable attention to this process, many questions remain ...

  • Molecular interactions of tannic acid with proteins associated with SARS-CoV-2 infectivity 

    Haddad, Mohamed; Gaudreault, Roger; Sasseville, Gabriel; Nguyen, Phuong Trang; Wiebe, Hannah; Van De Ven, Theo; Bourgault, Steve; Mousseau, Normand; Ramassamy, Charles (MDPI, 2022-02-27)
    The overall impact of severe acute respiratory syndrome coronavirus 2 (SARS-CoV-2) on our society is unprecedented. The identification of small natural ligands that could prevent the entry and/or replication of the coronavirus remains a pertinent ...