Chemistry Machine Learning Engineer at Barrington James in Santa Rosa, California

Posted in Other 2 days ago.

Type: full-time





Job Description:

** ML Engineer (AI 4 Chemistry) - New Opportunity - San Francisco/Hybrid **

I'm seeking a Chemistry Machine Learning Engineer / Cheminformatics ML Scientist to join my client in building AI systems that replace lab and animal toxicity experiments with cutting-edge machine learning.

In this role, you'll work at the intersection of AI, chemistry, and drug discovery, partnering with top biotech and pharma teams to push real drug programs forward. You'll analyze AI/ML predictions on molecular structures, guide experimental design, and directly influence the development of a next-generation AI-driven platform. Your work will have a tangible impact on 100s of drug programs, shaping how new medicines are discovered.

We're looking for candidates with expertise in computational chemistry, cheminformatics, or ML for chemistry, ideally with industry experience in drug discovery. You should be proficient in Python, cheminformatics libraries (RDKit, Datamol), and molecular modeling techniques, with a passion for improving state-of-the-art AI models. Strong communication skills and the ability to engage with scientific teams, present research, and shape AI-driven solutions are essential.

If you're excited about redefining how AI is used in chemistry, let's connect!
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