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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 Intern Project: High-throughput generation of structural isomers for fast development of molecular datasets to train machine learning algorithms
Anna Catton, Francisco Martin-Martinez, Samantha Kanza, Jeremy G. Frey & Victoria Hooper, 2021
DOI: 10.5258/SOTON/AI3SD0141
Type: report
AI3SD Intern Project: Latent Space Encoding of Molecular Crystal Structures
King Wong, Graeme M. Day, Samantha Kanza, Jeremy G. Frey & Victoria Hooper, 2021
DOI: 10.5258/SOTON/AI3SD0150
Type: report
AI3SD Intern Project: Machine Learning Physics Models for Materials Self-Assembly
Aspen Fenzl, Nigel Clarke, Samantha Kanza, Jeremy G. Frey & Victoria Hooper, 2021
DOI: 10.5258/SOTON/AI3SD0142
Type: report
AI3SD Intern Project: Predicting IUPAC names of inorganic compounds with deep learning
Thomas Allam, Simon J. Coles, Samantha Kanza, Nicola Knight & Victoria Hooper, 2021
DOI: 10.5258/SOTON/AI3SD0148
Type: report
AI3SD intern project: Reaction condition optimisation
Rubaiyat Khondaker, Stephen Gow, Samantha Kanza & Jeremy G. Frey, 2021
DOI: 10.5258/SOTON/AI3SD0153
Type: report