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effective way of synthesizing industrially valuable chemicals. Carboxylic acid reductases (CARs) are essential enzymes involved in the biosynthesis of aldehydes from carboxylic acids. Therefore, CARs have
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-based approaches (such as DFT and AIMD), thermodynamics and kinetics as well as finite element methods will be applied to perform a rapid and reliable screening of various compositions in the search
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(such as DFT and AIMD), thermodynamics and kinetics as well as finite element methods will be applied to perform a rapid and reliable screening of various compositions in the search for optimal ones, so that
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Science, or Theoretical/Computational Chemistry and a subsequent PhD Degree Profound programming skills in python and its ML and NN modules Extensive background in ML, NN and related deep learning methods
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you have: Completed university studies (masters degree) and a doctoral degree in computer science, applied mathematics, computational science (physics, math, chemistry,..) and engineering or a related