postdoc computational chemistry

University of Southampton invites applications for a 24-month postdoctoral fellowship in computational inorganic chemistry within the EXPRESS Programme. The successful candidate will model precursor complexes, explore solvent speciation, and collaborate closely with electrochemistry experimentalists and an inorganic synthesis team.Strong experience with...

University of Birmingham is seeking a Research Fellow (Post-doc) in Computational Structural Biology. The role focuses on membrane proteins, protein–ligand complexes and macromolecular assemblies using advanced MD and enhanced-sampling methods.It combines computational approaches with experimental data in a vibrant, international research group. The...

University of Bristol invites applications for three postdoctoral research associate positions in the Aggarwal Lab to develop novel boron-based synthetic methodologies. The role centers on designing and synthesizing complex molecules and expanding lithiation-borylation approaches for C–C bond formation.Successful candidates will work on multiple projects...

Research Fellow in Computational ChemistryThis job is only available to University of Leeds staff. It may be released externally should we not appoint internally.Are you a researcher looking for a new challenge? Do you have background in Computational Chemistry or Physics? Do you have an experience in computational chemistry? Are you interested in ultrafast...

The University of Oxford is seeking a Computational Postdoctoral Research Associate to lead molecular simulation work for the Gr-ADI project. You will conduct free energy calculations to identify mutations affecting ligand binding, guiding lead optimisation against Klebsiella pneumoniae targets.Based in the MMM Unit at Oxford's John Radcliffe Hospital, you...

Research Scientist (Computational Chemistry) About Us We are a global technology company, driving energy innovation for a balanced planet. At SLB we create amazing technology that unlocks access to energy for the benefit of all. As innovators, that has been our mission for 100 years. We are facing the world’s greatest balancing act: how to simultaneously...

LOCATION: King’s Cross, London · PATTERN: Hybrid, flexible for the right candidate The opportunity We’re a stealth startup in AI and bio, building infrastructure for data generation. The team is small and elite, the problems are hard, and the foundations are being laid right now. You’d help write them from the first line, with real ownership and a...

Lilly is seeking an expert computational chemist to advance hit-to-lead programs using state‑of‑the‑art virtual screening, AI/ML, and cheminformatics. You will partner with LSMD and ExploR&D to deliver data‑driven designs and robust models that accelerate biotech collaborations.The role emphasizes leadership, cross‑functional teamwork, and a...

LOCATION: King’s Cross, London · PATTERN: Hybrid, flexible for the right candidate The opportunity We’re a stealth startup in AI and bio, building infrastructure for data generation. The team is small and elite, the problems are hard, and the foundations are being laid right now. You’d help write them from the first line, with real ownership and a...

Job IntroductionDirector / Senior Director – Computational ChemistryLocation: Hoddesdon, UK and remoteThe OpportunityPharmaron is a global contract research and manufacturing organization (CRO/CDMO) helping pharma and biotech companies bring new therapies to life. With over 25,000 employees worldwide across 28 locations in the UK, US, China, and...

SLB Cambridge Research is seeking a postdoctoral researcher in computational chemistry to develop molecular modeling and simulation approaches for energy, materials, and sustainability applications. The role focuses on accelerating chemical and materials discovery and translating molecular insights into practical engineering solutions.Applications may...

University of Bristol is seeking a Postdoctoral Research Associate to contribute to the development of novel synthetic boron-based methodologies. The role focuses on design and synthesis, employing lithiation-borylation to build carbon frameworks and expand boron chemistry, under supervision by Aggarwal FRS and Crump.The ideal candidate will have recent...

This early-stage venture is building a discovery engine for chemistry, comprising a platform for running end-to-end simulations of chemical reaction systems, and a world model + agent stack that uses the simulation platform to discover new chemistry.Their goal is to build backend scientific data infrastructure to meet the demands of AI systems that can truly...

Job IntroductionSenior Principal Scientist / Director – Computational Chemistry (IDD)Location: UK – RemoteAbout PharmaronPharmaron is a global contract research and manufacturing organization (CRO/CDMO) helping pharma and biotech companies bring new therapies to life. With over 25,000 employees worldwide across 28 locations in the UK, US, China, and...

Liverpool School of Tropical Medicine is seeking an experienced Post Doctoral Research Associate to support a multidisciplinary research programme investigating insecticide-treated materials and chemically functionalised surfaces. The postholder will lead surface and fibre characterisation using Cryo-SEM/EDS and Raman microscopy, complemented by LC-MS/MS,...

University of Oxford invites applications for a Postdoctoral Research Associate in Natural Product Chemistry. You will lead a biochemical project exploring antifungal compounds derived from bdelloid rotifers, joining a multidisciplinary team spanning Biology, Pharmacology and Chemistry at Oxford.The role requires a PhD in chemistry/biochemistry or chemical...

The University of Birmingham invites applications for a PhD studentship in Computational Chemistry of Thermal Batteries. Based in the School of Chemistry, this fully-funded position focuses on connecting material structure with thermal-battery performance through computational methods.Candidates will develop modelling approaches, conduct independent...

Atlantic is building a discovery engine for chemistry, combining end-to-end reaction simulations with a world model and agent stack. You will help shape the scientific foundations and integrate state-of-the-art methods with machine learning to accelerate chemical discovery.You will own the development and validation of computational chemistry components,...

About Gramian Gramian Consultancy is a boutique consultancy specializing in IT professional services and engineering talent solutions. With a strong background in software engineering and leadership, we help companies build high-performing teams by matching them with professionals who truly fit their needs. About the Role We are seeking a Chemistry and...

About Gramian Gramian Consultancy is a boutique consultancy specializing in IT professional services and engineering talent solutions. With a strong background in software engineering and leadership, we help companies build high-performing teams by matching them with professionals who truly fit their needs. About The Role We are seeking a Chemistry and...