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Job in California, St. Mary's County, Maryland, 20619, USA
Listing for: SLS Services Limited
Full Time position
Listed on 2026-05-27
Job specializations:
  • Research/Development
    Data Scientist
  • IT/Tech
    Data Scientist, Machine Learning/ ML Engineer
Salary/Wage Range or Industry Benchmark: 100000 - 125000 USD Yearly USD 100000.00 125000.00 YEAR
Job Description & How to Apply Below

Are you ready to shape the next generation of AI research in molecular science?

This is a unique opportunity to join a dynamic team at the cutting edge of machine learning research, where you’ll have the chance to design, experiment, and implement groundbreaking models that power large-scale scientific discovery. We are looking for an ML Research Engineer with a passion for solving complex problems, blending research ingenuity with robust engineering skills.

The Employer

Join a mission-driven, well-funded organization pioneering the convergence of AI and chemistry. By building advanced foundation models for molecular-level biology, they are pushing beyond traditional limits of drug discovery. Operating at massive scale across compute, data, and innovation, this is a place for ambitious minds who value collaboration, creativity, and executional excellence. Here, your impact will span from early-stage ideas all the way to production-level systems used in real-world breakthroughs.

Qualifications

& Experience
  • Strong software engineering fundamentals, including reproducible pipelines and documentation
  • Demonstrated contributions in ML or scientific computing (e.g., Git Hub projects or publications)
  • Solid working knowledge of PyTorch, JAX, and modern ML research stacks
  • Familiarity with large-scale compute environments and high-throughput experimentation
  • Scientific depth via industry experience or a relevant PhD
Responsibilities
  • You will drive research engineering initiatives that explore new frontiers of molecular modeling and simulation.
  • Design and execute experiments to test foundation model hypotheses
  • Build and maintain robust, scalable libraries for training, evaluation, and simulation
  • Implement cutting-edge model architectures from literature and internal research
  • Develop meaningful evaluation metrics for rapid iteration and model improvement
  • Support research workflows, including manuscripts, datasets, and reproducible tooling
Skills / Technical Competencies
  • Programming:
    Python, PyTorch, JAX
  • Systems: HPC experience, distributed compute
  • Research Development:
    Experimentation frameworks, evaluation methodologies
Nice to Haves
  • Knowledge of geometric deep learning, equivariant models, or GNNs
  • Familiarity with generative modeling (diffusion, flow matching, score-based)
  • Contributions to open-source projects in ML or scientific computing
  • Experience with agent-driven research systems and active learning pipelines
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