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Research project

From Lab to Literature and back

Staff

Lead researchers

Professor Jeremy Frey

Professor of Physical Chemistry
Connect with Jeremy

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

Other researchers

Professor Jonathan Essex

Professor
Research interests
  • Molecular simulations of biological systems
  • Computer aided drug discovery
  • Method development in molecular simulations
Connect with Jonathan

Email: J.W.Essex@soton.ac.uk

Professor Mike Surridge

Professorial Fellow Information Tech
Research interests
  • Computer Networks Security
  • Automated cyber security risk assessment and management
Connect with Mike

Email: ms8@soton.ac.uk

Emeritus Professor Susan Lewis

Connect with Susan

Email: S.M.Lewis@soton.ac.uk

Professor Dave Woods

Professor of Statistics
Research interests
  • Design of experiments
  • Bayesian statistics
  • Statistical computing
Connect with Dave

Email: D.Woods@soton.ac.uk

Professor Sujit Sahu

Professor of Statistics
Research interests
  • Applied Bayesian modelling
  • Bayesian computation
  • Spatio-temporal data modelling
Connect with Sujit

Email: S.K.Sahu@soton.ac.uk

Collaborating research institutes, centres and groups

Research outputs

The evolution of digital chemistry at Southampton
Colin Bird, Simon J. Coles & Jeremy G. Frey, 2015, Molecular Informatics
DOI: 10.1002/minf.201500008
Type: article
ChemTrove: Enabling a generic ELN to support chemistry through the use of transferable plug-ins and online data sources
Aileen E. Day, Simon Coles, Colin Bird, Jeremy Frey, Richard Whitby, Valery E. Tkachenko & Antony J. Williams, 2015, Journal of Chemical Information and Modeling, 55(3), 501-509
DOI: 10.1021/ci5005948
Type: article
Collection, curation, citation at source: Publication@Source 10 years on
Jeremy Frey, Simon Coles, Colin Bird & Cerys Willoughby, 2015, International Journal of Digital Curation, 10(2), 1-11
DOI: 10.2218/ijdc.v10i2.377
Type: article
Scientific and technical data sharing: a trading perspective
Jeremy G. Frey & Colin L. Bird, 2014, Journal of Computer-Aided Molecular Design, 28(10), 989-996
DOI: 10.1007/s10822-014-9785-4
Type: article
A vision and a necessity for the 21st century
Jeremy G. Frey, 2014, Chemistry International, 36(1)
DOI: 10.1515/ci.2014.36.1.14
Type: article
Cheminformatics and the Semantic Web: adding value with linked data and enhanced provenance
Jeremy G. Frey & Colin Bird, 2013, Wiley Interdisciplinary Reviews: Computational Molecular Science, 3(5), 465-481
DOI: 10.1002/wcms.1127
Type: article
Chemical information matters: an e-Research perspective on information and data sharing in the chemical sciences
Colin Bird & Jeremy G. Frey, 2013, Chemical Society Reviews, 42(16), 6754-6775
DOI: 10.1039/C3CS60050E
Type: article