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candidate to perform molecular dynamics simulations of different genetic variants of the sodium channel Nav1.1, which are associated with different forms of epileptic syndromes and migraine. The aim
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-chemical-physics/ ) led by Prof. Alexandre Tkachenko at the Department of Physics and Material Science, we are looking for a PhD candidate to perform molecular dynamics simulations of different genetic
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dynamics simulations. The project will entail programming (scripting, Python etc.), handling big data and carrying out all-atom and coarse-grained molecular dynamics simulations on high-performance super
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during downstream processing. Theoretical investigation of molecule stability during DSP, using molecular interaction simulations such as e.g. Molecular dynamics (MD). Combination of PAT and data driven
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dynamics (MD) simulations represent a powerful tool to study such interfaces, but MD of nanomaterial/liquid interfaces require well-calibrated intermolecular potentials, which don’t currently exist
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. Predicting proton transfer mechanisms in polymer electrolyte membranes. Investigating structural and dipole dynamics in molecular electrets. Predicting formation processes and reaction mechanisms
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, biophysics Machine learning and generative AI Molecular modeling and molecular dynamics simulations LNP formulation and characterisation including e.g. small angle scattering, microscopy, single particle
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tuneable materials for Earth-abundant solid-state electrolytes using atomistic simulations (primarily density functional theory, DFT, and molecular dynamics, MD) as well as developing machine learning models
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-supervisor. Your immediate leader will be the Head of Department. Duties of the position Develop and test new models and protocols using classical simulation methods such as Molecular Dynamics (MD) and Monte
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Republic, announces an opening for a PhD position in the area of molecular modeling of biomolecules with a focus on molecular dynamics simulations of nucleic acids and proteins. The candidate will be involved (among