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technology. Development of cutting edge foundation models for protein design, small molecule property prediction, or protein function prediction Data generation and curation, including molecular simulation and
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, carbohydrate-active enzymes, polymer chemistry, spectroscopic methods, material science, 3D-printing, statistical physics and molecular dynamic simulations, formulation technologies. Excellent communication
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applications: Establish a light-induced multi-physics and multiscale phase change simulation platform, which allows us to capture LAI and couple molecular information into macroscopic phase change simulation
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time-scales: ab initio methods for the description of reaction processes, for the determination of electrochemical stabilities and for the optimisation of force fields; molecular dynamics simulations