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Polymers using a combination of quantum and force field-based simulations that will be further integrated into a force field-based Molecular Dynamics (MD) approaches to assess the permeability and
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molecular dynamics simulations across multiple resolutions, most likely from the atomistic to the coarse grained level, using a variety of force fields and computational methods. Run large-scale simulations
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simulation methods, such as molecular dynamics, molecular docking, virtual screenig, and free energy calculations; c) Experience with molecular-based artificial intelligence methods; d) Programming skills. 4
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) points; b) Experience in molecular simulation methods, such as molecular dynamics, molecular docking, virtual screenig, and free energy calculations; c) Experience with molecular-based artificial
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We are looking for a highly motivated and dynamic Postdoctoral fellow with a PhD or equivalent degree to join the Merino Group at the Novo Nordisk Foundation Center for Basic Metabolic Research
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molecular dynamics; and enhanced-sampling free-energy methods (e.g., metadynamics and thermodynamic integration) to quantify adsorption and interfacial reaction processes. The research also includes method
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SD- 26053 PHD IN ULTRA-FAST MACHINE-LEARNING INTERATOMIC POTENTIALS FOR NANOINDENTATION OF TIC MA...
dynamics (MD) simulations of different materials families composed of Ti and C. Titanium carbides, for example, exhibit exceptional hardness, high melting point, wear and abrasion resistance, and many other
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Goethe University Frankfurt am Main invites applications for two positions of Professor (W2 or W3) in cellular biochemistry and Professor (W2 or W3) in molecular biochemistry as part of the SCALE
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. Job Requirements: PhD degree in Civil and Environmental Engineering or related field Relevant research experience on geotechnical engineering Relevant research experience in molecular dynamics
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experience on geotechnical engineering Relevant research experience in molecular dynamics simulations and computational fluid dynamics will be preferred. Excellent proposal writing and report writing skill