Research Associate in Computational Chemistry and Molecular Simulation Research

University of Bristol Law School; Bristol; On-site; GBP 38,000 - 45,000; Full time

Job summary

A renowned academic institution in Bristol is offering a postdoctoral research position focused on computational chemistry and enzyme dynamics. Candidates should have a PhD in a relevant field and experience in molecular simulation and machine learning. The role involves development of simulation methods and collaboration with experimental biochemists. This full-time position will remain open until September 2026, with a salary range of £38,249 to £44,128 per annum.

Qualifications

• Motivated computational molecular scientist.
• Experience with molecular simulation methods.
• Strong background in computational chemistry.

Responsibilities

• Develop and apply molecular simulation methods.
• Model protein dynamics and interactions.
• Collaborate with experimental biochemists.

Skills

Computational chemistry

Molecular simulation

Machine learning

Data analysis

High-performance computing

Education

PhD in Chemistry, Biochemistry, or related field

Job description

The role

A postdoctoral research position is available in the group of Prof. Adrian Mulholland at the University of Bristol, funded by the European Research Council (ERC) Advanced Project PREDACTED. The project focuses on applying computational chemistry and molecular simulation methods to investigate enzyme dynamics, activity, and inhibition, with a particular focus on enzymes involved in antibiotic resistance.

What will you be doing?

You will develop and apply molecular simulation methods to model protein dynamics and interactions, including the development of machine learning-based methods. Your work will involve simulating enzyme complexes, testing ligand binding effects, analyzing mutations, and contributing to enzyme and inhibitor design, in collaboration with experimental biochemists and structural biologists.

You should apply if

You are a motivated computational molecular scientist with a PhD in Chemistry, Biochemistry, or a related field, with expertise in computational chemistry, molecular simulation, and machine learning. This position offers experience in simulation methods, data analysis, high-performance computing, and collaboration with experimental research.

Additional information

• Contract: Open-ended until 30/09/2026
• Work pattern: Full-time, 35 hours/week
• Grade: I/Pathway 2
• Salary: £38,249 - £44,128 per annum
• Application deadline: 31/07/2025 at 23:59 UK time
• Contact: Prof. Adrian Mulholland, [e-mail]

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