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Machine Learning Scientist - Synthesis Planning and Optimization

Genentech, Inc

basel, basel city, Switzerland Full-time June 13, 2026

Found Description

Join the small-molecule team within AI for Drug Discovery (AI4DD), formerly Prescient Design, at Roche and Genentech’s Computational Sciences Center of Excellence as a Machine Learning Scientist / Senior Machine Learning Scientist in Synthesis Planning and Optimization. You will build ML methods that design molecules we can actually make — closing the loop between generative design and automated synthesis.

The Opportunity:

  • Develop and advance machine learning methods for synthesis-aware molecular design across retrosynthesis, synthesis planning, molecular generation, and search in synthesizable chemical spaces.
  • Integrate proprietary reaction and biochemical data to design the next generation of synthesis-aware models and workflows for hit finding and optimisation.
  • Build robust, scalable pipelines for active-learning loops that interface directly with automated and high-throughput synthesis platforms.
  • Design...
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