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proteins in lipid droplets; (2) development and maintenance of the POP_MD code for non-equilibrium molecular dynamics simulations of biological systems. The successful candidate will be responsible
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Innsbruck (J.Phys.Chem.A2021,125,7662−7669) in an existing machine. The successful candidate will be responsible for the theoretical design (SIMION simulations), mechanical design (SOLIDWORKS), and final
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kinetic properties associated with a transformation, using artificial intelligence tools * performing molecular dynamics simulations * developing codes to analyze these simulations, using existing
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The researcher will study the potential of atto-photochemistry on organic or inorganic photoinduced reactions. He or she will use quantum chemistry and molecular dynamics methods to do so. The overall objective is
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ExperienceNone Additional Information Eligibility criteria Python programming. Analysis and development of ML and DL models using standard data science libraries. Data engineering from molecular dynamics
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more than 300 researchers, engineers, and students working across analytical chemistry, physico‑chemistry, environmental science, and materials science. CAPT combines quantum chemistry, molecular dynamics
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research laboratory in solid-state physics, nanoscience, molecular chemistry, and materials science. Its activities range from the synthesis of (nano)materials and molecular systems to the study and modeling