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MPI-INF D3 Publications, generated: 7:34, 23 October 2019

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Your search returned the following 16 documents:

  1. Andreas Steffen, Maximilian Karasz, Carolin Thiele, Thomas Lengauer, Andreas Kämper, Gerhard Wenz, and Joannis Apostolakis
    Combined similarity and QSPR virtual screening for guest molecules of $\beta$-cyclodextrin
    New Journal of Chemistry 31 (11): 1941-1949, 2007
  2. Andreas Steffen, Carolin Thiele, Simon Tietze, Christian Strassnig, Andreas Kämper, Thomas Lengauer, Gerhard Wenz, and Joannis Apostolakis
    Improved cyclodextrin-based receptors for camptothecin by inverse virtual screening
    Chemistry 13 (24): 6801-6809, 2007
  3. Andreas Kämper, Didier Rognan, and Thomas Lengauer
    Lead Identification by Virtual Screening
    In: Bioinformatics - From Genomes to Therapies 2. Getting at the Inner Workings: Molecular Interactions, 2007, 651-704
  4. Andreas Steffen, Andreas Kämper, and Thomas Lengauer
    Flexible Docking of Ligands into Synthetic Receptors Using a Two-Sided Incremental Construction Algorithm
    Journal of Chemical Information and Modeling 46 (4): 1695-1703, 2006
  5. Andreas Kämper, Joannis Apostolakis, Matthias Rarey, Christel Maria Marian, and Thomas Lengauer
    Fully Automated Flexible Docking of Ligands into Flexible Synthetic Receptors Using Forward and Inverse Docking Strategies
    Journal of Chemical Information and Modeling 46 (2): 903-911, 2006
  6. Andreas Steffen, Andreas Kämper, and Thomas Lengauer
    Virtual screening for guest molecules of a biosensor
    In: Biosensors 2006: The ninth world congress on biosensors, Toronto, Canada, 2006, O66 p.
  7. Andreas Kämper, Melanie Kaspar, and Thomas Lengauer
    Efficient conformational analysis of synthetic receptors with macrocyclic and fused ring systems
    In: Synthetic Receptors 2005: Second World Congress on Synthetic Receptors, Salzburg, Austria, 2005, O4 p.. Note: Abstract for an oral presentation at the conference
  8. Andreas Steffen, Andreas Kämper, and Thomas Lengauer
    FlexR - A new tool for predicting the structure of synthetic host-guest complexes
    In: Synthetic Receptors 2005: Second World Congress on Synthetic Receptors, Salzburg, Austria, 2005, O7 p., paper no. O7.. Note: Abstract for an oral presentation at the conference
  9. Andreas Steffen, Andreas Kämper, and Thomas Lengauer
    Development of a new tool for predicting the structure of host-guest complexes
    In: Proceedings of the 2nd Summer School Medicinal Chemistry Regensburg 2004, Regensburg, Germany, 2004, 83 p.
  10. Andreas Steffen, Andreas Kämper, and Thomas Lengauer
    FlexR - Predicting the structure of host-guest complexes
    In: Proceedings of the Annual Meeting of the German Pharmaceutical Society - Joint Meeting 2004 (DPhG 2004), Regensburg, Germany, 2004, 130 p.
  11. Andreas Kämper and Thomas Lengauer
    Virtual Screening for novel Urease Inhibitors
    In: Proceedings of the International Workshop on New Approaches in Drug Design & Discovery, Marburg, Germany, 2003, 39 p.
  12. Andreas Kämper and Thomas Lengauer
    ECLIPPSE: Environment for Chemical Library Inspection, Pre- and Postprocessing, and Screening Evaluation. User Guide

  13. Andreas Kämper, Joannis Apostolakis, and Thomas Lengauer
    Docking of Bacterial Cell-Wall Fragments into Glycopeptide Antibiotics
    In: From Genes to Drugs via Crystallography: 33rd crytallographic course at the E. Majorana Center, Erice, Italy, 2002, 49 p.
  14. Andreas Kämper and Thomas Lengauer
    Docking of Ligands into Molecular Tweezers and Molecular Clips
    In: Workshop of the SFB 624 'Templates', Walberberg, Germany, 2002
  15. Andreas Kämper, Joannis Apostolakis, Matthias Rarey, Christel Maria Marian, and Thomas Lengauer
    Docking of Ligands into Artificial Receptors
    In: Electronically Excited Molecules: Structure and Dynamics, 37th Symposium for Theoretical Chemistry, Bad Herrenalb, Germany, Sep. 23-29, 2001, 2001, P76 p.
  16. Andreas Kämper, Joannis Apostolakis, Matthias Rarey, Christel Maria Marian, and Thomas Lengauer
    Docking of Ligands into Artificial Receptors
    Poster at the Annual Meeting of the German CHemical Society, Würzburg, Germany