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Director of Computational Drug Design

Isomorphic LabsCambridge, MA
On-site Full-time

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Experience Level

Senior Level Manager

Qualifications

To excel in this role, you should possess a PhD in Computational Chemistry, Chemical Engineering, or a related field, with substantial experience in computational drug design. Proficiency in molecular modeling, simulation, and the application of machine learning techniques in drug discovery is essential. Strong analytical skills and the ability to collaborate effectively within a multidisciplinary team are critical. A passion for innovation and a drive to contribute to groundbreaking research will set you apart.

About the job

Role Overview

Isomorphic Labs is seeking a Director of Computational Drug Design to join its Cambridge, MA site. This leader will shape computational chemistry strategy for both internal research and collaborative projects. The position sits within the Drug Design and Medical Research division, working closely with AI and machine learning specialists to advance the company’s drug design engine and accelerate new medicine development.

About Isomorphic Labs

Founded in 2021, Isomorphic Labs (IsoLabs) builds on the AlphaFold system, applying advanced AI to solve complex problems in human health. The team combines drug discovery expertise with machine learning to create predictive and generative models that speed up scientific discovery. The company’s mission is to design novel molecules, predict drug performance, and develop new treatments for challenging diseases by modeling biological systems with AI.

Isomorphic Labs has developed an AI-driven drug design engine capable across various therapeutic areas and drug types. The organization continues to refine model architectures and expand capabilities, aiming to realize the promise of digital biology and ultimately eradicate disease through artificial intelligence.

About the Computational Drug Design Team

The Cambridge-based Computational Drug Design team brings together computational chemists focused on driving strategy, supporting both internal and partner projects. Close collaboration with AI/ML colleagues is central to the group’s work, ensuring the continued evolution of the Isomorphic Labs Drug Design Engine. The team values a supportive environment, ongoing learning, and professional development for every member.

About Isomorphic Labs

Isomorphic Labs is committed to advancing human health through innovative technologies. Our interdisciplinary approach combines the fields of AI and drug discovery to expedite the development of novel therapies, aiming for a future free from disease.

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