This position will contribute to the UKRI NERC-funded project “Defining species sensitivities to endocrine-disrupting chemicals” led by Brunel University of London in collaboration with the University of Southampton. The project aims to develop innovative computational approaches to predict which vertebrate species are most sensitive to endocrine-disrupting chemicals and to identify the molecular and structural features underlying differences in sensitivity. It will investigate nine families of nuclear receptors across fish, amphibians, reptiles, birds and mammals.

College / Directorate College of Engineering, Design & Physical Sciences Department Department of Computer Science Full Time / Part Time Full Time Posted Date 10/08/2026 Closing Date 21/09/2026 Ref No 5193 Position Title: Research Fellow: AI for Molecular Modelling – 16961 Department/College: Computer Sciences / College of Engineering, Design and Physical Sciences Location: Brunel University of London, Uxbridge Campus Salary: Grade R1 from: £41,292 to £44,762 per annum inclusive of London Weighting with potential to progress to £48,557 per annum inclusive of London Weighting through sustained exceptional contribution. (Pro-rata for Part-time) Hours: Full-time Contract Type: Fixed-term until 30/11/2028 Brunel University of London was established in 1966 and is a leading multidisciplinary research-intensive technology university delivering economic, social and cultural perks.

For more information please visit: https://www.brunel.ac.uk/about/our-history/home The Department of Computer Science at Brunel, where this project will be based, has a strong record of internationally recognised research.



In the 2020–2025 editions of the NTU Performance Ranking of Scientific Papers for World Universities, Computer Science at Brunel was ranked in the top 10 in the UK overall. It was also ranked first in the UK for H-index and highly cited papers for five consecutive years.

More recently, Brunel was ranked 48th worldwide for Artificial Intelligence in the 2025 Shanghai Global Ranking of Academic Subjects. This position will contribute to the UKRI NERC-funded project “Defining species sensitivities to endocrine-disrupting chemicals” led by Brunel University of London in collaboration with the University of Southampton. The project aims to develop innovative computational approaches to predict which vertebrate species are most sensitive to endocrine-disrupting chemicals and to identify the molecular and structural features underlying differences in sensitivity.

It will investigate nine families of nuclear receptors across fish, amphibians, reptiles, birds and mammals.

The Research

Fellow will deliver the computational component of the project through protein structure modelling, molecular docking and detailed analysis of protein-ligand interactions. They will integrate these results with receptor-interaction data generated by the experimental collaborators at the University of Southampton to develop and evaluate artificial intelligence (AI) methods for predicting chemical binding and species sensitivity.



We are looking for a computational scientist with an interest in interdisciplinary research applied to biological and toxicological sciences.

Preference will be given to candidates with knowledge and experience of protein molecular modelling, protein–ligand docking, machine learning methods for computational biology, and software development in Python. Please upload your CV (including publications) and a Cover letter summarising your experience and achievements in the application system. For an informal discussion, please email Dr Alessandro Pandini at [email protected] We offer a generous annual leave package plus discretionary University closure days, excellent training and development opportunities as well as a great occupational pension scheme and a range of health-related support.

The University is committed to a hybrid working approach.

Closing date for applications: 21September 2026 For further details about the post including the and Person Specification and to apply please visit https://careers.brunel.ac.uk If you have any technical issues please contact us at: [email protected] All Applicants should be eligible to live and work in the UK for the duration of any offer of appointment. A Basic Disclosure and Barring Service (DBS) check is required for this role.

Brunel

University of London wishes to promote an inclusive and diverse workforce and create a culture that values the contribution of all backgrounds and communities. All employees will be recruited, selected and appointed in line with our equality and diversity policy.

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📌 Research Fellow: AI for Molecular Modelling - 16961 (Uxbridge)
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📍 Uxbridge