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Gerhard Klebe: [Publications] [Author Rank by year] [Co-authors] [Prefers] [Cites] [Cited by]

Publications of Author

  1. C. H. Schwab, Sandra Handschuh, Andreas Teckentrup, Markus Wagener, Jens Sadowski, Johann Gasteiger, Paul Levi, T. Will, Andreas Zell, H. Siemens, Gerhard Klebe, Thomas Mietzner, Frank Weber, Gerhard Barnickel, Scheila Anzali, Michael Krug
    A Systemsatic Approach to Finding New Lead Structures Having Biological Activity. [Citation Graph (0, 0)][DBLP]
    German Conference on Bioinformatics - Selected Papers, 1996, pp:166-177 [Conf]
  2. Nils Weskamp, Eyke Hüllermeier, Daniel Kuhn, Gerhard Klebe
    Graph Alignments: A New Concept to Detect Conserved Regions in Protein Active Sites. [Citation Graph (0, 0)][DBLP]
    German Conference on Bioinformatics, 2004, pp:131-140 [Conf]
  3. Nils Weskamp, Daniel Kuhn, Eyke Hüllermeier, Gerhard Klebe
    Efficient Similarity Search in Protein Structure Databases: Improving Cliqae-Detection through Clique Hashing. [Citation Graph (0, 0)][DBLP]
    German Conference on Bioinformatics, 2003, pp:179-184 [Conf]
  4. Gerhard Klebe
    Durch die Berechnung von Moleküleigenschaften zum gezielten Entwurf von neuen Wirkstoffen. [Citation Graph (0, 0)][DBLP]
    Supercomputer, 1989, pp:147-160 [Conf]
  5. Nils Weskamp, Daniel Kuhn, Eyke Hüllermeier, Gerhard Klebe
    Efficient similarity search in protein structure databases by k-clique hashing. [Citation Graph (0, 0)][DBLP]
    Bioinformatics, 2004, v:20, n:10, pp:1522-1526 [Journal]
  6. Gerhard Klebe, Ute Abraham
    Comparative Molecular Similarity Index Analysis (CoMSIA) to study hydrogen-bonding properties and to score combinatorial libraries. [Citation Graph (0, 0)][DBLP]
    Journal of Computer-Aided Molecular Design, 1999, v:13, n:1, pp:1-10 [Journal]
  7. Gerhard Klebe, Thomas Mietzner
    A fast and efficient method to generate biologically relevant conformations. [Citation Graph (0, 0)][DBLP]
    Journal of Computer-Aided Molecular Design, 1994, v:8, n:5, pp:583-606 [Journal]
  8. Gerhard Klebe, Thomas Mietzner, Frank Weber
    Different approaches toward an automatic structural alignment of drug moleculars: Applications to sterol mimics, thrombin and thermolysin inhibitors. [Citation Graph (0, 0)][DBLP]
    Journal of Computer-Aided Molecular Design, 1994, v:8, n:6, pp:751-778 [Journal]
  9. Gerhard Klebe, Thomas Mietzner, Frank Weber
    Methodological developments and strategies for a fast flexible superposition of drug-size molecules. [Citation Graph (0, 0)][DBLP]
    Journal of Computer-Aided Molecular Design, 1999, v:13, n:1, pp:35-49 [Journal]
  10. J. Willem, M. Nissink, Marcel L. Verdonk, Gerhard Klebe
    Simple knowledge-based descriptors to predict protein-ligand interactions. Methodology and validation. [Citation Graph (0, 0)][DBLP]
    Journal of Computer-Aided Molecular Design, 2000, v:14, n:8, pp:787-803 [Journal]
  11. J. W. M. Nissink, Marcel L. Verdonk, Jan Kroon, Thomas Mietzner, Gerhard Klebe
    Superposition of molecules: Electron density fitting by application of fourier transforms. [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 1997, v:18, n:5, pp:638-645 [Journal]
  12. Jonas Boström, Markus Böhm, Klaus Gundertofte, Gerhard Klebe
    A 3D QSAR Study on a Set of Dopamine D4 Receptor Antagonists. [Citation Graph (0, 0)][DBLP]
    Journal of Chemical Information and Computer Sciences, 2003, v:43, n:3, pp:1020-1027 [Journal]
  13. Jens Sadowski, Johann Gasteiger, Gerhard Klebe
    Comparison of Automatic Three-Dimensional Model Builders Using 639 X-ray Structures. [Citation Graph (0, 0)][DBLP]
    Journal of Chemical Information and Computer Sciences, 1994, v:34, n:4, pp:1000-1008 [Journal]
  14. Peter Block, Christoph A. Sotriffer, Ingo Dramburg, Gerhard Klebe
    AffinDB: a freely accessible database of affinities for protein-ligand complexes from the PDB. [Citation Graph (0, 0)][DBLP]
    Nucleic Acids Research, 2006, v:34, n:Database-Issue, pp:522-526 [Journal]
  15. Nils Weskamp, Eyke Hüllermeier, Daniel Kuhn, Gerhard Klebe
    Multiple Graph Alignment for the Structural Analysis of Protein Active Sites. [Citation Graph (0, 0)][DBLP]
    IEEE/ACM Trans. Comput. Biology Bioinform., 2007, v:4, n:2, pp:310-320 [Journal]

  16. Graph Alignment: Fuzzy Pattern Mining for the Structural Analysis of Protein Active Sites. [Citation Graph (, )][DBLP]


  17. Efficient Construction of Multiple Geometrical Alignments for the Comparison of Protein Binding Sites. [Citation Graph (, )][DBLP]


  18. Evolutionary construction of multiple graph alignments for the structural analysis of biomolecules. [Citation Graph (, )][DBLP]


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