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Director, Computational Sciences

North Chicago, IL, us💼 Full-time🗓 2026-08-20 → 2026-09-26

Core

Lead a global computational chemistry team to drive AI and physics-based modeling for drug discovery, from lead optimization through clinical development, supporting the design of drug candidates with optimal developability properties.

Role type

Director, Computational Sciences (Leadership)

Builds

Hierarchical modeling approaches integrating physics-based atomistic methods (molecular dynamics, quantum mechanics) with machine learning and AI for precision predictions in drug discovery.

Domain

Biopharmaceuticals / Computational Chemistry / AI in Drug Discovery

Deliverable

production ML models | product features

Required skills

Quantum mechanics, atomistic molecular simulations, molecular dynamics, AI/machine learning, team leadership, strategic planning, cross-functional collaboration, external partnership building, project management, scientific publication record

Preferred skills

Experience in matrixed leadership, mentoring early/mid-career scientists, navigating cross-functional boundaries, executive presence

Technologies

Molecular dynamics, quantum mechanics, machine learning, artificial intelligence, hybrid physics-informed AI/ML models

Responsibilities

Align strategies and research activities with Development Sciences and Discovery leaders; develop and implement strategies for AI-enabled drug discovery; manage multiple projects and team leaders impacting long-term strategy; identify and manage external research collaborations; manage project intake and capacity planning for the small molecule portfolio; lead innovation in methodologies and emerging technology trends; guide the development and democratization of computational models; ensure robust model/data management.

Seniority

Director, strategic leadership with hands-on scientific oversight

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