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Research project

Artificial and Augmented Intelligence for Automated Scientific Discovery

Staff

Lead researchers

Professor Jeremy Frey

Professor of Physical Chemistry
Connect with Jeremy

Email: J.G.Frey@soton.ac.uk

Other researchers

Professor Mahesan Niranjan

ISIS Chair
Connect with Mahesan

Email: mn@ecs.soton.ac.uk

Collaborating research institutes, centres and groups

Research outputs

AI3SD Series: Failed it to Nailed it!
Samantha Kanza, Nicola Knight, Jeremy G. Frey, Simon J. Coles & Sarah Callaghan, 2021
DOI: 10.5258/SOTON/AI3SD0270
Type: conference
AI3SD Video: Chemical space exploration
Jan Jansen, Jeremy G. Frey, Samantha Kanza & Mahesan Niranjan, 2021
DOI: 10.5258/SOTON/AI3SD0170
Type: conference
AI3SD Video: Hyperparameter optimisation for graph neural networks
Yingfang (James) Yuan, Jeremy G. Frey, Samantha Kanza & Mahesan Niranjan, 2021
DOI: 10.5258/SOTON/AI3SD0171
Type: conference
AI3SD Video: A vision of medicinal chemistry for the future
Lewis Vidler, Jeremy G. Frey, Samantha Kanza & Mahesan Niranjan, 2021
DOI: 10.5258/SOTON/AI3SD0167
Type: conference
AI3SD Video: The universal digital twin – accessing the world of chemistry
Markus Kraft, Jeremy G. Frey, Samantha Kanza & Mahesan Niranjan, 2021
DOI: 10.5258/SOTON/AI3SD0169
Type: conference
AI3SD Video: What a medicinal chemist needs to know about explainable artificial intelligence
Alexander G. Dossetter, Jeremy G. Frey, Samantha Kanza & Mahesan Niranjan, 2021
DOI: 10.5258/SOTON/AI3SD0168
Type: conference
Considering the ethical implications of digital collaboration in the Food Sector
Naomi Jacobs, Stephen, Jonathan Brewer, Peter Craigon, Jeremy G. Frey, Anabel Gutierrez, Samantha Kanza, Louise Manning, Samuel Munday, Simon Pearson & Justin Sacks, 2021, Patterns, 2(11)
DOI: 10.1016/j.patter.2021.100335
Type: article