MoSS : A Program for Molecular Substructure Mininig

Borgelt, Christian; Meinl, Thorsten; Berthold, Michael R.

MoSS : A Program for Molecular Substructure Mininig

Dateien

MoSS.pdfGröße: 248.9 KBDownloads: 454

Datum

2005

Open Access-Veröffentlichung

Open Access Green

Sammlungen

Informatik und Informationswissenschaft

Publikationstyp

Beitrag zu einem Konferenzband

Publikationsstatus

Published

Erschienen in

GOETHALS, Bart, ed. and others. OSDM '05 : proceedings of the 1st international workshop on open source data mining ; frequent pattern mining implementations. New York: ACM Press, 2005, pp. 6-15. ISBN 1-59593-210-0

Zusammenfassung

Molecular substructure mining is currently an intensively studied research area. In this paper we present an implementation of an algorithm for finding frequent substructures in a set of molecules, which may also be used to find substructures that discriminate well between a focus and a complement group. In addition to the basic algorithm, we discuss advanced pruning techniques, demonstrating their effectiveness with experiments on two publicly available molecular data sets, and briefly mention some other extensions.

Fachgebiet (DDC)

004 Informatik

Zitieren

ISO 690

BORGELT, Christian, Thorsten MEINL, Michael R. BERTHOLD, 2005. MoSS : A Program for Molecular Substructure Mininig. In: GOETHALS, Bart, ed. and others. OSDM '05 : proceedings of the 1st international workshop on open source data mining ; frequent pattern mining implementations. New York: ACM Press, 2005, pp. 6-15. ISBN 1-59593-210-0

BibTex

@inproceedings{Borgelt2005Progr-5550,
  year={2005},
  title={MoSS : A Program for Molecular Substructure Mininig},
  isbn={1-59593-210-0},
  publisher={ACM Press},
  address={New York},
  booktitle={OSDM '05 : proceedings of the 1st international workshop on open source data mining ; frequent pattern mining implementations},
  pages={6--15},
  editor={Goethals, Bart},
  author={Borgelt, Christian and Meinl, Thorsten and Berthold, Michael R.}
}

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Universitätsbibliographie

Ja