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Extended Functional Groups (EFG): An Efficient Set for Chemical Characterization and Structure-Activity Relationship

Elena S Salmina1, Norbert Haider2, Igor V Tetko3,4

  • 1Institute for Organic Chemistry, Technical University Bergakademie Freiberg, Leipziger Str. 29, Freiberg D-09596, Germany. salmina@mailserver.tu-freiberg.de.

Molecules (Basel, Switzerland)
|December 26, 2015
PubMed

Keywords:
chemical functional groupschemoinformatics analysisdata interpretationheterocyclic compoundsmachine learning

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