Principal Computational Chemist

Posted:
4/15/2026, 7:24:45 PM

Location(s):
Greater London, England, United Kingdom ⋅ Ile-de-France, France ⋅ England, United Kingdom ⋅ Paris, Ile-de-France, France

Experience Level(s):
Expert or higher ⋅ Senior

Field(s):
AI & Machine Learning ⋅ Data & Analytics

Workplace Type:
Hybrid

About AQEMIA

AQEMIA is a drug invention company dedicated to creating entirely new medicines to address major unmet medical needs. At the core of our mission is QEMI, our proprietary molecule-invention platform, which uniquely combines cutting-edge science with advanced technology. Powered by physics-based modeling, statistical mechanics, and generative AI, QEMI allows our teams to design novel drug candidates from first principles.

What makes AQEMIA different is our commitment to true innovation: our research is dedicated to the invention of new molecular entities, not the refinement of existing ones. We focus on inventing never-before-seen molecules, without relying on experimental data, and advancing them into a growing pipeline of proprietary programs and strategic partnerships with leading pharmaceutical companies.

Our most advanced preclinical programs are currently in vivo optimization, targeting diseases still waiting for effective treatments, offering our teams the opportunity to work on science that can make a real difference in people’s lives.

For more information, visit AQEMIA.com and our LinkedIn

About our Team

AQEMIA brings together a diverse, multidisciplinary team of 65+ professionals based in Paris and London. Our scientists and engineers, including chemists, physicists, machine learning experts, and software engineers, work side by side to push the boundaries of early-stage drug discovery.

This close collaboration across disciplines is central to our approach, enabling us to tackle complex scientific challenges from first principles and translate cutting-edge ideas into novel therapeutic candidates. At AQEMIA, team members are encouraged to contribute their expertise, learn from one another, and play an active role in shaping the future of drug invention.

The Role

As a Principal Computational Chemist, you'll lead the end-to-end design of validated drug candidates using Aqemia's computational platform (generative AI, physics-based methods). You'll operate at the intersection of cutting-edge algorithms, molecular simulations, and medicinal chemistry. Your project experience is your greatest asset: every compound you design, every calculation you run, and every workflow bottleneck you encounter will drive improvements to our computational capabilities.

Please note that Aqemia currently only offers visa sponsorship for roles based in our Paris location. We will be accepting applications until 1st May. Once the role closes, our team will review all submissions and reach out to candidates selected for interview.

Why Join Us ?

At AQEMIA, we work for a mission: joining us means having your own impact on changing the way drugs are discovered, and helping to shape the direction of our fast-growing company and team.

Expanding Drug Discovery Pipeline : Focused on critical therapeutic areas like Oncology, CNS, Immuno-inflammation... with in vivo proof of concept/patent stage programs. Collaborations with top Pharma, including a $140M Sanofi deal.
World-Class Interdisciplinary Team : work alongside exceptional talent at the intersection of technology and life sciences. Our teams combine deep expertise in AI, physics-based modeling, biology, and medicinal chemistry to push the boundaries of innovation.
DeepTech Recognition: AQEMIA is proud to be part of the French Tech 120 and France 2030, highlighting our role as a key player in Europe’s DeepTech ecosystem.
Prime Location with Flexibility : Our offices are located in the heart of Paris and London (King’s Cross), with flexible work arrangements including up to two remote days per week.
Strong Financial Backing : $100M raised from leading European and International investors

Aqemia

Website: http://www.aqemia.com/

Headquarter Location: Paris, Ile-de-France, France

Employee Count: 11-50

Year Founded: 2019

IPO Status: Private

Last Funding Type: Series A

Industries: Artificial Intelligence (AI) ⋅ Biotechnology ⋅ Machine Learning ⋅ Pharmaceutical ⋅ Quantum Computing