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Molecular hydrophobicity at a macroscopically hydrophilic surfaceProceedings of the National Academy of Sciences of the United States of America, 2018, 116 (5), pp.1520-1525. ⟨10.1073/PNAS.1819000116⟩
Article dans une revue
hal-02110446v1
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Water orientation and hydrogen-bond structure at the fluorite/water interfaceScientific Reports, 2016, 6 (1), pp.24287. ⟨10.1038/srep24287⟩
Article dans une revue
hal-02065254v1
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Thermodynamics of 5-Bromouracil Tautomerization From First-Principles Molecular Dynamics SimulationsElsevier, 116 (5), pp.109-128, 2019, ⟨10.1016/bs.aiq.2018.05.001⟩
Chapitre d'ouvrage
hal-02572267v1
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