Kalai Vanii Jayaseelan

Summary

Affiliation: Wellcome Trust Genome Campus
Country: UK

Publications

  1. pmc Building blocks for automated elucidation of metabolites: natural product-likeness for candidate ranking
    Kalai Vanii Jayaseelan
    Cheminformatics and Metabolism, European Molecular Biology Laboratory European Bioinformatics Institute EMBL EBI, Wellcome Trust Genome Campus, Hinxton, Cambridge CB10 1SD, UK
    BMC Bioinformatics 15:234. 2014
  2. pmc Natural product-likeness score revisited: an open-source, open-data implementation
    Kalai Vanii Jayaseelan
    Chemoinformatics and Metabolism, European Bioinformatics Institute EBI, UK
    BMC Bioinformatics 13:106. 2012
  3. pmc New developments on the cheminformatics open workflow environment CDK-Taverna
    Andreas Truszkowski
    Chemoinformatics and Metabolism, European Bioinformatics Institute EBI, Cambridge, UK
    J Cheminform 3:54. 2011

Collaborators

Detail Information

Publications3

  1. pmc Building blocks for automated elucidation of metabolites: natural product-likeness for candidate ranking
    Kalai Vanii Jayaseelan
    Cheminformatics and Metabolism, European Molecular Biology Laboratory European Bioinformatics Institute EMBL EBI, Wellcome Trust Genome Campus, Hinxton, Cambridge CB10 1SD, UK
    BMC Bioinformatics 15:234. 2014
    ....
  2. pmc Natural product-likeness score revisited: an open-source, open-data implementation
    Kalai Vanii Jayaseelan
    Chemoinformatics and Metabolism, European Bioinformatics Institute EBI, UK
    BMC Bioinformatics 13:106. 2012
    ..In this note, we report an open-source and open-data re-implementation of this scoring system, illustrate its efficiency in ranking small molecules for natural product likeness and discuss its potential applications...
  3. pmc New developments on the cheminformatics open workflow environment CDK-Taverna
    Andreas Truszkowski
    Chemoinformatics and Metabolism, European Bioinformatics Institute EBI, Cambridge, UK
    J Cheminform 3:54. 2011
    ..abstract:..