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understanding of the mechanisms that support their development in humans is therefore of major therapeutic interest. The aim of the thesis project is to decipher the cellular and molecular mechanisms supporting
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be done via computer simulations, including Monte Carlo and molecular dynamics, combined with the use of statistical mechanics to predict e.g. phase transitions, nucleation rates, etc. The work will be
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of the mechanism of the electro-conversion of isopropanol to acetone and, subsequently, to propose alternative catalysts (other than Pt-Ru) with improved stability. The computations will primarily be conducted using
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Chemistry and Microbiology Cluster (CME Cluster), whose research focuses on understanding the mechanisms (physico-chemical and (micro)biological) at different scales (from the molecule to the ecosystem