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Autonomous ML Scientist for Agentic Small-Molecule Design

Roche | basel, Switzerland | Posted June 26, 2026

Position Overview

Roche is seeking a Machine Learning Scientist in Basel to join their small-molecule team within AI for Drug Discovery. You will develop LLM-driven agentic workflows for drug design, collaborating with world-class chemists and biologists.

The ideal candidate holds a PhD and has extensive experience with machine learning, Python, and cheminformatics tools. This role promises to significantly impact drug discovery processes at Roche.

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