Identification of target-specific bioisosteric fragments from ligand-protein crystallographic data

Kennewell, E., Willett, P., Ducrot, P. and Luttmann, C. (2006) Identification of target-specific bioisosteric fragments from ligand-protein crystallographic data. Journal of Computer-Aided Molecular Design, 20 (6). pp. 385-394. ISSN 0920-654X

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Authors/Creators:
  • Kennewell, E.
  • Willett, P.
  • Ducrot, P.
  • Luttmann, C.
Copyright, Publisher and Additional Information: © Springer Science+Business Media B.V. 2006. This is an author produced version of a paper published in Journal of Computer-Aided Molecular Design. Uploaded in accordance with the publisher's self-archiving policy.
Keywords: bioisostere, fragment substructure, ligand-protein complex, protein data bank, shape similarity
Institution: The University of Sheffield
Academic Units: The University of Sheffield > Faculty of Social Sciences (Sheffield) > Information School (Sheffield)
The University of Sheffield > University of Sheffield Research Centres and Institutes > The Krebs Institute for Biomolecular Research (Sheffield)
Depositing User: Repository Officer
Date Deposited: 29 Jan 2008 11:24
Last Modified: 08 Feb 2013 16:55
Published Version: http://dx.doi.org/10.1007/s10822-006-9072-0
Status: Published
Publisher: Springer
Refereed: Yes
Identification Number: 10.1007/s10822-006-9072-0

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