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Field
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focuses on using molecular modeling techniques to study protein-ligand interactions. The Carlsson group uses structure-based methods (e.g., molecular docking and molecular dynamics simulations
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. Computational fluid dynamics is an essential enabler for science and for many outstanding societal challenges. Many key advanced and emerging technologies require unprecedented control of heat and mass transfer
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Karlsruher Institut für Technologie (KIT) | Karlsruhe, Baden W rttemberg | Germany | about 1 month ago
gap are to be described with molecular dynamics simulation methods and coupled to a global fluid mechanics simulation. Furthermore, the obtained pressure distribution in the lubrication gap leads
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influences on which structures are formed experimentally. The successful candidate will also be expected to perform molecular dynamics and density functional theory simulations on the predicted materials and
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parameterized for these functionalized and solvated quantum dots. The tools developed will first be used in molecular dynamics simulations to determine molecular descriptors making it possible to understand
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molecular simulations, which must characterize the DNA aptamers; their bonding with the electrodes and redox molecules; their dynamical fluctuation trajectory in solution, under realistic conditions; the
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high-resolution microscopy and single cell genomics to infer evolutionary history and life cycle dynamics of hitherto undescribed fungal species and lineages. We are looking for a PhD student who will
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. The problem with classical molecular dynamics is that for molecules of this size atomistic simulations can be done on the time scale of picoseconds but the time scale of important biological processes such as
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and applications. Excellent written communication skills, as evidenced in application materials. Preferred Qualifications Experience with molecular dynamics simulations and analyses, cheminformatics
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labelled for single-molecule FRET experiments in vitro and used to construct molecular models of their complexes with reconstituted nucleosomes. NMR spectroscopy and various other biophysical methods will be