All Stories

  1. Identifying Ebola virus inhibitors using machine learning

    Article • F1000Research, October 2015, Faculty of 1000, Ltd.

    Dr Sean Ekins, Alex Michael Clark

  2. Creating open source Bayesian models with a big dataset

    Article • Journal of Chemical Information and Computer Sciences, June 2015, American Chemical Society (ACS)

    Dr Sean Ekins, Alex Michael Clark

  3. Using open source Bayesian models for drug discovery

    Article • Journal of Chemical Information and Computer Sciences, June 2015, American Chemical Society (ACS)

    Dr Sean Ekins, Alex Michael Clark

  4. Publishing chemistry data in a way that allows computers to actually use it

    Article • Journal of Cheminformatics, March 2015, Springer Science + Business Media

    Dr Antony John Williams, Alex Michael Clark, Dr Sean Ekins

  5. Major overhaul of the TB Mobile app and description of ECFP_6/FCFP_6 fingerprints in CDK project

    Article • Journal of Cheminformatics, August 2014, Springer Science + Business Media

    Dr Sean Ekins, Alex Michael Clark

  6. Can drug discovery become more effective using open data and prediction tools?

    Article • Journal of Computer-Aided Molecular Design, June 2014, Springer Science + Business Media

    Dr Antony John Williams, Dr Sean Ekins, Alex Michael Clark, Dr Nadia Litterman

  7. Predicting the efficiency of chemical compounds against the Tuberculosis bacterium

    Article • Journal of Chemical Information and Modeling, April 2014, American Chemical Society (ACS)

    Dr Antony John Williams, Dr Sean Ekins, Joel Freundlich, Alex Michael Clark

  8. Champions for rare diseases - an app idea

    Article • Molecular Genetics and Metabolism, February 2014, Elsevier

    Dr Sean Ekins, Alex Michael Clark

  9. TB mobile for target prediction

    Article • Journal of Cheminformatics, March 2013, Springer Science + Business Media

    Dr Sean Ekins, Alex Michael Clark

  10. Sharing precompetitive data and models may accelerate drug discovery

    Article • Drug Discovery Today, March 2013, Elsevier

    Dr Antony John Williams, Dr Sean Ekins, Alex Michael Clark

  11. Turning chemical structure files into manuscript quality graphical diagrams

    Article • Molecular Informatics, March 2013, Wiley

    Alex Michael Clark

  12. Using a mobile app to raise awareness of Sanfilippo Syndrome type C

    Article • Molecular Genetics and Metabolism, February 2013, Elsevier

    Dr Sean Ekins, Alex Michael Clark

  13. Using Mobile Technologies for Cheminformatics Applications

    Article • Chem-Bio Informatics Journal, January 2013, Chem-Bio Informatics Society

    Dr Antony John Williams, Dr Sean Ekins, Alex Michael Clark

  14. How Mobile Devices and Apps for Green Chemistry can bring value to scientists

    Article • ACS Sustainable Chemistry & Engineering, December 2012, American Chemical Society (ACS)

    Dr Antony John Williams, Dr Sean Ekins, Alex Michael Clark

  15. Delivering an app on a mobile platform to enable collaboration in open drug discovery

    Article • Molecular Informatics, August 2012, Wiley

    Dr Antony John Williams, Dr Sean Ekins, Alex Michael Clark

  16. Using mobile apps for the application of cheminformatics - making it intuitive

    Article • Molecular Informatics, July 2012, Wiley

    Dr Antony John Williams, Dr Sean Ekins, Alex Michael Clark

  17. Representing chemical structures other than just organic molecules

    Article • Journal of Chemical Information and Modeling, December 2011, American Chemical Society (ACS)

    Alex Michael Clark

  18. Mobile apps for chemistry

    Article • Drug Discovery Today, November 2011, Elsevier

    Dr Antony John Williams, Dr Sean Ekins, Alex Michael Clark

  19. Basic primitives for molecular diagram sketching

    Article • Journal of Cheminformatics, October 2010, Springer Science + Business Media

    Alex Michael Clark

  20. 2D Depiction of Fragment Hierarchies

    Article • Journal of Chemical Information and Modeling, December 2009, American Chemical Society (ACS)

    Alex Michael Clark

  21. Detection and Assignment of Common Scaffolds in Project Databases of Lead Molecules

    Article • Journal of Medicinal Chemistry, December 2008, American Chemical Society (ACS)

    Alex Michael Clark

  22. 2D Depiction of Protein—Ligand Complexes.

    Article • ChemInform, November 2007, Wiley

    Alex Michael Clark

  23. Flexible 3D pharmacophores as descriptors of dynamic biological space

    Article • Journal of Molecular Graphics and Modelling, October 2007, Elsevier

    Alex Michael Clark

  24. 2D Depiction of Protein−Ligand Complexes

    Article • Journal of Chemical Information and Modeling, August 2007, American Chemical Society (ACS)

    Alex Michael Clark

  25. 2D Structure Depiction.

    Article • ChemInform, July 2006, Wiley

    Alex Michael Clark

  26. 2D Structure Depiction

    Article • Journal of Chemical Information and Modeling, April 2006, American Chemical Society (ACS)

    Alex Michael Clark

  27. Stepwise Conversion of an Osmium Trimethylstannyl Complex to a Triiodostannyl Complex and Nucleophilic Substitution Reactions at the Tin−Iodine Bonds

    Article • Organometallics, April 2000, American Chemical Society (ACS)

    Alex Michael Clark, Professor Leonard James Wright

  28. Cyclometallated complexes of ruthenium and osmium containing the o-C6H4PPh2 ligand

    Article • Journal of Organometallic Chemistry, April 2000, Elsevier

    Alex Michael Clark, Professor Leonard James Wright

  29. Bromination and nitration reactions of metallated (Ru and Os) multiaromatic ligands and crystal structures of selected products

    Article • Journal of Organometallic Chemistry, April 2000, Elsevier

    Alex Michael Clark, Professor Leonard James Wright

  30. Bis(N,N′-dimethylimidazol-2-ylidene)mercury chlorotriiodomercury dimethyl sulfoxide solvate

    Article • Acta Crystallographica Section C Crystal Structure Communications, January 2000, International Union of Crystallography

    Alex Michael Clark, Professor Leonard James Wright

  31. The origin of the ‘spike’ in the EPR spectrum of C60−

    Article • Chemical Communications, January 2000, Royal Society of Chemistry

    Alex Michael Clark

  32. Electrophilic Substitution Reactions at the Phenyl Ring of the Chelated 2-(2‘-Pyridyl)phenyl Ligand Bound to Ruthenium(II) or Osmium(II)

    Article • Organometallics, June 1999, American Chemical Society (ACS)

    Alex Michael Clark, Professor Leonard James Wright

  33. Osmium nitrosyl complexes with osmium-tin bonds crystal structure of Os[Sn(p-tolyl)3](NO)(CO)2(PPh3)

    Article • Journal of Organometallic Chemistry, September 1997, Elsevier

    Alex Michael Clark, Professor Leonard James Wright

  34. Osmium complexes containing either chelating or non-chelating 8-quinolyl ligands

    Article • Journal of Organometallic Chemistry, January 1997, Elsevier

    Alex Michael Clark, Professor Leonard James Wright