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Job description
About the Position
Advances in AI, data, and computational sciences are transforming drug discovery and development. Roche’s Research and Early Development organisations at Genentech (gRED) and Pharma (pRED) have demonstrated how these technologies accelerate R&D, leveraging data and novel computational models to drive impact. Seamless data sharing and access to models across gRED and pRED are essential to maximising these opportunities. The new Computational Sciences Center of Excellence (CoE) is a strategic, unified group whose goal is to harness the transformative power of data and Artificial Intelligence (AI) to assist our scientists in both pRED and gRED to deliver more innovative and transformative medicines for patients worldwide.
Responsibilities
Design and build foundation models to support target and drug discovery, with a focus on large-scale representation learning, multimodal generative models, LLMs, AI agents, and reinforcement learning.Work with and integrate diverse data modalities such as molecular structures, biological sequences, omics data, biochemical readouts, and text.Bridge cutting-edge AI models and applications supporting target discovery, experimental design, and lab-in-the-loop pipelines.Scale frontier AI models to massive datasets working at the intersection of deep learning and engineering challenges, focusing on system design, architectural choices, and scalability, in collaboration with engineering and MLOps teams.Publish in top-tier ML venues and scientific journals, and present results at internal and external conferences and workshops.Collaborate closely with interdisciplinary and cross-functional teams across gRED and Roche.
Requirements
Ph.D. in Computer Science, Machine Learning, Computational Biology, or a related quantitative field0 – 2+ years of industry or post-doc experienceProven track record advancing ML models in research and/or industry settings, particularly in large-scale representation learning, multimodal generative models, LLMs, AI agents, and reinforcement learning.Demonstrated interest in advancing AI for scientific applications spanning biology, chemistry, and drug discovery.Excellent knowledge of the theory and practice of deep learning.Proven experience developing and delivering innovative ML solutions in the areas above.Excellent Python programming skills, fluency with modern agentic coding environments, and extensive experience with ML frameworks such as PyTorch or JAX.Strong grasp of software engineering, data engineering, and MLOps best practices (e.g., version control, high-performance compute infrastructures, and ML experiment monitoring workflows).Strong publication record and active contribution to research communities, including top-tier ML venues such as NeurIPS, ICML, ICLR, AAAI, ACL, EMNLP, AISTATS, etc. and/or public portfolio of relevant projects (e.g. hosted on GitHub/GitLab).Excellent communication, collaboration, and problem-solving skills.
Nice-to-Haves
Practical experience bridging innovative ML methods and applications in target/drug discovery.Experience with biological and chemical modalities and tasks such as molecular structures, single-cell/omics data, perturbation biology, and multimodal biological datasets.Hands‑on experience developing, finetuning, and optimizing LLMs and agentic systems.
Benefits
A discretionary annual bonus may be available based on individual and Company performance.This position also qualifies for the benefits detailed at the link provided below.
Company
Genentech
Experience Level
Senior (5+ years of experience)
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Worksite address
daly city, CA, 94013, US
Who can apply
Review the original listing for work authorization, qualifications and employer requirements.