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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 video: AI4SD & IoFT AI for ethics working group: introducing the working group & our methodologies: moral IT cards & design fiction.
Samantha Kanza, Naomi Jacobs, Peter Craigon, Jeremy G. Frey & Mahesan Niranjan, 2022
DOI: 10.5258/SOTON/AI3SD0211
Type: conference
AI3SD video: Bayesian optimisation in chemistry
Rubaiyat Khondaker, Jeremy G. Frey, Samantha Kanza & Mahesan Niranjan, 2022
DOI: 10.5258/SOTON/AI3SD0216
Type: conference
AI3SD video: curated large inorganic datasets of reconnected InChI, InChI and IUPAC name
Thomas Allam, Jeremy G. Frey, Samantha Kanza & Mahesan Niranjan, 2022
DOI: 10.5258/SOTON/AI3SD0214
Type: conference
AI3SD video: development of a full stack for digital R&D in chemistry and chemical process development
Alexei A. Lapkin, Jeremy G. Frey, Samantha Kanza & Mahesan Niranjan, 2022
DOI: 10.5258/SOTON/AI3SD0209
Type: conference
AI3SD video: harnessing advanced algorithms to enable the automated optimisation of telescoped chemical reactions; performance directed self-optimisation of bimetallic nanoparticle catalysts
Thomas Chamberlain, Jeremy G. Frey, Samantha Kanza & Mahesan Niranjan, 2022
DOI: 10.5258/SOTON/AI3SD0212
Type: conference
AI3SD video: internship talk – high-throughput generation of chemical isomers for the development of molecular models of biocrude oils
Francisco Martin-Martinez, Jeremy G. Frey, Mahesan Niranjan & Samantha Kanza, 2022
DOI: 10.5258/SOTON/AI3SD0213
Type: conference
AI3SD video: internship talk – making music with automated processes and AI for the AI3SD Network
Mubin Kazmi, Jeremy G. Frey, Samantha Kanza & Mahesan Niranjan, 2022
DOI: 10.5258/SOTON/AI3SD0215
Type: conference