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The National Center of Excellence for the Molecular Prediction of Inflammatory Bowel Disease, PREDICT, is looking to recruit a highly skilled and motivated PhD student in metabolomics and
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crystallinity. Therefor prior knowledge of state-of-the-art modelling software and molecular dynamics simulations and quantum mechanical calculations to elucidate the reaction mechanism, together with AI based
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(density functional theory and ab-initio molecular dynamics simulations) with artificial intelligence techniques to parameterize machine learning force fields and kinetic Monte Carlo methods to model
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