- Sandia National Laboratories (Livermore, CA)
- …biofuel development + genomics and biological systems + chemical reaction processes + molecular dynamics + quantum sensing + advanced laser diagnostics + ... exascale simulations of reacting flows + uncertainty quantification + machine learning and stochastic modeling + advanced engine combustion + advanced materials for hydrogen storage + advanced materials for neuromorphic and quantum computing + advanced fusion… more
- Carnegie Mellon University (Pittsburgh, PA)
- …**Preferred Qualifications:** + M.Sc. degree. + Experience in computational biophysics and molecular dynamics (algorithms and current practice). + Experience in ... AI/ML. + Experience in application performance optimization. + Familiarity with parallel programming models (eg, OpenMP, MPI, CUDA). + Experience parallelizing serial computational applications. + Experience in data analytics. + Proficiency with one or more of… more
- Carnegie Mellon University (Pittsburgh, PA)
- …+ Ph.D. degree. + Demonstrated expertise in computational biophysics and molecular dynamics (algorithms and current practice). + Demonstrated expertise ... in AI/ML. + Proven track record in application performance optimization. + Advanced experience with parallel programming models (eg, OpenMP, MPI, CUDA). + Extensive experience parallelizing serial computational applications. + Strong background in data… more
- Takeda Pharmaceuticals (Boston, MA)
- …scalable high-performance computing (HPC) solutions on AWS for computational chemistry, molecular dynamics , and large-scale genomics workflows. + Lead the ... planning, execution, and integration of HPC projects, ensuring timely, within-budget delivery and alignment with enterprise systems. + Partner with strategy, architecture, and business teams to analyze requirements, identify opportunities, and drive technology… more
- AbbVie (North Chicago, IL)
- …of formulation development and characterization experiments. + Advanced kinetic modeling and molecular dynamics simulations. + Design of Experiments (DoE) and ... statistical data analyses. + Authoring technical reports and scientific presentations. Qualifications Minimum Qualifications + Currently enrolled in university, pursuing a PhD in pharmaceutical sciences, chemistry, chemical engineering or other related field.… more
- Genentech (South San Francisco, CA)
- …simulation for peptide design and optimization, including conformational sampling and molecular dynamics (MD) simulations. + Proficiency in structure-based drug ... design and ligand-based drug design to guide peptide modifications. + Familiarity with machine learning and AI-driven platforms for predicting peptide properties, optimizing sequences, and generating novel scaffolds. + Experience using common computational… more
- New Jersey Institute of Technology (Newark, NJ)
- …Prerequisite Qualifications: -A good understanding of computer simulations (eg, molecular dynamics , all-atom simulations, coarse-grained models, and enhanced ... sampling methods) proven through the publication of scientific articles. -Knowledge of protein aggregation, and protein-membrane interactions is also desired. -Clear oral communication with proven experience in writing scientific papers. -Basic knowledge of… more
- Takeda Pharmaceuticals (Boston, MA)
- …variety of computational tools and methodologies including docking, virtual screening, molecular dynamics , free energy perturbation, homology modeling, quantum ... mechanics, pharmacophore elucidation, data mining, machine learning, cheminformatics, clustering, similarity & diversity analysis. + Significant Industry experience contributing as Computational Chemist on drug discovery projects. + Strong Impact in… more
- New York University (NY)
- …and a scientific knowledge or an interest in membrane biology and molecular mechanisms of cellular dynamics are highly desirable. Interested candidates ... The Aydin Lab in the Department of Molecular Pathobiology at New York University College of...a combination of physiology, biochemistry, structural biology tools, and molecular and functional imaging techniques. The qualified candidate will… more
- UTMB Health (Galveston, TX)
- Postdoctoral Fellow, Biochemistry & Molecular Biology **Galveston, Texas, United States** Training & Education UTMB Health Requisition # 2506608 The Molecular ... integrates chemical biology, biophysical, and structural approaches to elucidate molecular function and support rational drug design. **Key Responsibilities** +… more