- Argonne National Laboratory (Lemont, IL)
- …expect to work on enhancing the performance and scalability of large-scale molecular dynamics simulations (eg LAMMPS) using machine-learned potentials (eg MACE) ... and Teamwork Desired skills, knowledge and abilities: + Experience with large-scale molecular dynamics (MD) simulations using software, such as LAMMPS, and… more
- University of Florida (Gainesville, FL)
- …Successful candidates will work on spin transitions and magnetoelectric couplings in molecular magnetic systems, dynamics , and decoherence of spin and clock ... Post Doctoral Associate in the Center for Molecular Magnetic Quantum Materials (M2QM) Apply now (https://secure.dc4.pageuppeople.com/apply/674/gateway/default.aspx?c=apply&lJobID=524153&lJobSourceTypeID=796&sLanguage=en-us)… more
- Michigan State University (East Lansing, MI)
- …the Vermaas lab leverages computational methods such as atomistic or coarse-grained molecular dynamics simulations with both classical and machine-learned force ... fields to study key questions around these topics. By using and developing these molecular simulation tools, the Vermaas lab seeks to create a molecular -level… more
- Argonne National Laboratory (Lemont, IL)
- …Chicago, USA). The postdoctoral researcher will work on the development of large-scale molecular dynamics , AI and machine learning based analysis to understand ... Laboratory. Within the team we have extensive experience with large scale molecular dynamics simulations, first principles calculations, reactive empirical force… more
- Michigan State University (East Lansing, MI)
- …in cryo-EM data processing and structure determination. + Experience in molecular dynamics simulations. + Strong analytical, organizational, and communication ... data to resolve high-resolution structures and protein conformational states. + Perform molecular simulations to explore altered protein dynamics and ligand… more
- University of Delaware (Newark, DE)
- …virus. Preference will be given to applications with expertise in 1) protein dynamics ; 2) molecular dynamics simulations; and 3) high-performance computing ... and develop new scientific tools for the analysis of long-time and/or large-scale molecular dynamics simulations in collaboration with the PI. The postdoctoral… more
- North Carolina Agriculture & Technical State Unive (Greensboro, NC)
- …The research associate has a demonstrated track record in tissue engineering, molecular dynamics , machine learning or related disciplines. The research is ... theoretical and experimental background with evidence of skills on tissue engineering, molecular dynamics simulation and machine learning. 3. The candidate is… more
- Michigan State University (East Lansing, MI)
- …requires the development and application of advanced computational tools such as molecular dynamics simulations and novel machine learning approaches. Research ... in the laboratory of Michael Feig in the Department of Biochemistry and Molecular Biology at Michigan State University. The Research Associate will focus on… more
- Merck (Rahway, NJ)
- …ophthalmic routes of administration + Develop multiscale models integrating coarse-grain molecular dynamics (CGMD), CFD-FEA Multiphysics to predict how process ... to building and applying Multiscale and Multiphysics modeling approaches-from molecular -level coarse-grained simulations to continuum-scale process modeling-to advance the… more
- Takeda Pharmaceuticals (Boston, MA)
- …candidate selection + Extensive knowledge of computational chemistry tools, including docking, molecular dynamics , FEP, QSAR modeling, and generative AI + Strong ... and developing a world-class team, and providing scientific leadership in molecular design and cheminformatics. The person will also spearhead our transformation… more
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