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, the primary unit of chromatin, using classical all-atom molecular dynamics simulations. The nucleosome is composed of a double-stranded DNA fragment wrapped around a protein core consisting of eight histones
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The University of North Carolina at Chapel Hill | Chapel Hill, North Carolina | United States | about 16 hours ago
://www.med.unc.edu/pharm/directory/yinglong-miao/) is looking for two highly motivated Postdoctoral fellows to work on accelerated molecular simulations and AI-driven drug discovery. Research projects in the Miao Lab
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University of North Carolina at Chapel Hill | Chapel Hill, North Carolina | United States | 1 day ago
analyzing molecular dynamics (MD) simulations to understand water and solute transport through highly crosslinked polyamide systems. The postdoctoral researcher will study polymer chemistry, crosslinking
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fundamental questions in statistical physics. The work is primarily numerical, and we seek candidates with experience in particle-based simulations (e.g., molecular dynamics) and a strong interest in large
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materials modeling and mechanics, including molecular simulations, multiscale modeling, and/or machine‑learning‑based materials design Demonstrated publication record in peer‑reviewed journals relevant
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identified around: theorists in quantum chemistry and molecular and reaction dynamics, organic synthesis chemists, physico-chemical experimenters (spectroscopy, photochemistry, molecular recognition and
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IT4Innovations National Supercomputing Center, VSB - Technical University of Ostrava | Czech | 10 days ago
investigations focused on spin dynamics, · Perform numerical simulations to study: - ultrafast magnetization phenomena, - interactions with surface acoustic waves, - propagation of sound waves in the presence of a
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on simulating nanoalloy structures to create a database for materials characterization. The main tasks include running molecular dynamics and Monte Carlo simulations to model nanoalloys under various
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IT4Innovations National Supercomputing Center, VSB - Technical University of Ostrava | Czech | 12 days ago
investigations focused on spin dynamics, · Perform numerical simulations to study: - ultrafast magnetization phenomena, - interactions with surface acoustic waves, - propagation of sound waves in the presence of a
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. Using all-atom molecular dynamics simulations and enhanced sampling techniques, the project will investigate how S-glutathionylation modulates nucleosome structure and dynamics, alone and in combination