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Senior Architect – Molecular Dynamics
Location
California + 1 moreAll locations: California | New York
Posted
108 days ago
Salary
$184K - $287.5K / year
Seniority
Senior
Job Description
Senior Architect – Molecular Dynamics
NVIDIA
• Developing and deploying functional forms for modern forcefields. • Prototyping and implementing enhanced sampling methods, including but not limited to: Gibbs sampling, umbrella sampling, REST2, SAMS, lambda dynamics, r-RESPA, and machine-learned samplers. • Integrating our libraries with various FEP, MD, and forcefield fitting workflows. • Working with our CUDA-X library team and other engineering teams to build GPU-friendly algorithms to ultimately accelerate the hardest and most time-consuming kernels in MD and making them widely accessible to developers around the world.
Job Requirements
- A Master’s or Ph.D. in Computer Science, Chemistry, Physics, or a related field (or equivalent experience).
- 8+ years of experience of methods development in MD, forcefield parameterization, and/or free energy methods.
- Proficiency in Python, C++, and/or CUDA, ideally in a setting with established best-practices such as code-reviews, unit testing, integration testing, etc.
- A deep understanding of trade-offs between practicality, generalizability, and performance of the solutions, and articulating them to both technical and non-technical experts.
Benefits
- equity
- benefits
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