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comprehensive computational modules that simulate the microbial behavior of bioproducts and quantify/estimate their resource dependencies across various scales. This PhD position is part of a unique
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years. Core competencies: ● Solid experience with molecular dynamics (MD) simulations and classical force fields (e.g., LAMMPS, GROMACS). ● Familiarity with polymer and ionic systems, surface interactions
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uses long timescale molecular dynamics (MD) simulations, integrated with experimental observables (especially cryo-electron microscopy data), and machine learning tools to better capture the dynamics
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SUSMAT-RC - Postdoc Position in Computer-Aided Design and Discovery of Sustainable Polymer Materials
dynamics, quantum mechanical simulations, and machine learning. Proficiency in programming languages and computational software’s. Strong motivation and passion for research in the field of sustainable
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-based methodologies for protein structure prediction and conformational ensamble • Molecular docking and cofolding • Molecular Dynamics simulations • Enhanced sampling Molecular Dynamics simulations Your
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group of researchers addressing complementary topics and methodology such as Experimental calibrations of volatile solubility laws, Molecular Dynamic simulations of silicate melts, Petrology of melting
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measure their mechanical, adhesive and frictional properties. By combining these data with classical molecular dynamics simulations and a molecular-scale approach to the thermodynamics of molecular
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deformation behaviors. This will be supported by numerical simulations developed by the LEM where nanoindentation simulations at the atomic scale will be performed by Molecular Dynamic (MD) as well as finite
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Leibniz-Institute for Food Systems Biology at the Technical University of Munich | Freising, Bayern | Germany | about 1 month ago
docking and cofolding Molecular Dynamics simulations Enhanced sampling Molecular Dynamics simulations Your Profile The ideal applicant has a strong background in bioinformatics or computational chemistry
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of Cellular and Molecular Medicine, Panum Institute, University of Copenhagen. We offer creative and stimulating working conditions in dynamic and international research environment. Our research facilities