Our Team

  • >_ Leadership Team
  • >_ Project Team
  • >_ Researchers
  • >_ ECR Committee
  • >_ Co-Investigators
Headshot of a woman. Name Chris Mellor

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Hub Co-Manager based at Imperial College. Chris has a PhD in Computational Chemistry and brings over 15 years’ experience working in research management roles within academia to the the hub.

Dr. Chris Mellor

Hub Co-Manager

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Hub Co-Manager based at University of Liverpool. Ben’s PhD and past research focused on the development of intelligent autonomous methodologies. He brings to the hub over 10 years of experience working in research management across both academia and industry.  

Dr. Ben Alston

Hub Co-Manager

Headshot of a woman. Name Chris Mellor

Title

Hub Co-Manager based at Imperial College. Chris has a PhD in Computational Chemistry and brings over 15 years’ experience working in research management roles within academia to the the hub.

Dr. Chris Mellor

Hub Co-Manager

Title

Hub Co-Manager based at University of Liverpool. Ben’s PhD and past research focused on the development of intelligent autonomous methodologies. He brings to the hub over 10 years of experience working in research management across both academia and industry.  

Dr. Ben Alston

Hub Co-Manager

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Hub Project Officer based at University of Liverpool. Caroline has over 14 years of expertise in project management, finance, and operational delivery.

Caroline Woods

Hub Project Officer

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Dan has a PhD in theoretical chemistry and experience as a software engineer at the intersection of AI and chemistry in both universities and industry. At AIchemy, he is developing software to support data management, autonomous labs and materials discovery. 

Dr. Dan Davies 

Senior Software Engineer

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Xue works at the intersection of material science, experimental chemistry and digital chemistry. She is currently developing tailored high-throughput automation workflows to support multi-fidelity AI research for reaction mechanism identification and optimization.

Dr. Xue Fang

Postdoctoral Research Assistant

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Pablo Graf is a Spanish/German PhD student at Imperial College. My research focuses on reaction mechanism discovery using high throughput experimentation and Bayesian optimization

Pablo Graf

PhD Student

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Federico obtained a Ph.D. in Computer Science from the University of Liverpool, where he worked in the domain of AI4Science, specializing in AI-driven materials discovery. His research interests include graph neural networks and deep generative models with applications in the Chemistry domain, targeting the generation of molecules and materials. He joined the AIchemy AI for Chemistry Hub as a postdoc in Jan 2025.

Dr. Federico Ottomano

Postdoctoral Research Assistant

>_ ECR Committee

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Keith is Associate Professor in Computational Materials Chemistry at UCL where he leads the Materials Design and Informatics Group. MDIG works in applied machine learning and atomistic simulation for the accelerated optimisation and discovery of new materials for green energy applications.

Dr. Keith Butler

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Tahereh Nematiaram is a Chancellor’s Fellow and Lecturer in the Department of Pure and Applied Chemistry at the University of Strathclyde. Specialising in developing innovative methods that integrate novel physical models with computational screening. Her research aims to identify advanced materials with targeted properties, determine the realistic physical limits, and drive practical design methods.

Dr. Tahereh Nematiaram

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John is a Lecturer in the Department of Chemistry at the University of Liverpool with expertise in synthetic organic methodology development, supramolecular chemistry, and functional materials. He is keen to develop new collaborations for large scale multidisciplinary projects applying AI and robotics to challenges in organic synthesis.

Dr. John Ward

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Adam is an Associate Professor in Digital Chemistry and Royal Academy of Engineering Research Fellow at the University of Leeds. His research focuses on integrating digital chemistry, machine learning, and process engineering to develop sustainable multistep continuous flow syntheses, combining autonomous reactors and optimisation algorithms to create catalytic cascades that reduce the carbon footprint of chemical manufacturing.

Dr. Adam Clayton

>_ Co-Investigators

Prof. Alessandro Troisi, University of Liverpool

Dr. Alex Ganose, Imperial

Dr. Antonio del Rio Chanona, Imperial

Prof. Aron Walsh, Imperial

Dr. Becky Greenaway, Imperial

Dr. Calvin Tsay, Imperial

Dr. David Wilkins, Queen’s University Belfast

Dr. Gabriella Pizzuto, University of Liverpool

Prof. Graeme Day, Univeristy of Southampton

Prof. Igor Larossa, University of Manchester

Dr. Jarvist Frost, Imperial

Dr. John Ward, University of Liverpool

Prof. Jordi Bures, University of Manchester

Dr. Keith Butler, UCL

Prof. Martijn Zwijnenburg, UCL

Prof. Matt Rosseinsky FRS, University of Liverpool

Dr. Matthew Dyer, University of Liverpool

Prof. Mimi Hii, Imperial

Prof. Rahul Savani, University of Liverpool

Prof. Sophia Yaliraki, Imperial

Dr. Tahereh Nematiaram, University of Strathclyde

Prof. Vitaly Kurlin, University of Liverpool

Dr. Vladimir Gusev, University of Liverpool

Prof. Volker Deringer, University of Oxford

Dr. Yingzhen Li, Imperial