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Journal of Chemical Information and Modeling, ‎1549-9596

Fachzeitschrift: Zeitschrift

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  1. Structrank: A new approach for ligand-based virtual Screening

    Rathke, F., Hansen, K., Brefeld, U. & Müller, K. R., 24.01.2011, in: Journal of Chemical Information and Modeling. 51, 1, S. 83-92 10 S.

    Publikation: Beiträge in Zeitschriften › Zeitschriftenaufsätze › Forschung › begutachtet

  2. Walk counts, labyrinthicity, and complexity of acyclic and cyclic graphs and molecules.

    Rücker, G. & Rücker, C., 2000, in: Journal of Chemical Information and Computer Sciences. 40, 1, S. 99-106 8 S.

    Publikation: Beiträge in Zeitschriften › Zeitschriftenaufsätze › Forschung › begutachtet

  3. Substructure, subgraph, and walk counts as measures of the complexity of graphs and molecules.

    Rücker, G. & Rücker, C., 01.11.2001, in: Journal of Chemical Information and Computer Sciences. 41, 6, S. 1457-1462 6 S.

    Publikation: Beiträge in Zeitschriften › Zeitschriftenaufsätze › Forschung › begutachtet

  4. Exploring the limits of graph invariant- and spectrum-based discrimination of (sub)structures.

    Rücker, C., Rücker, G. & Meringer, M., 05.2002, in: Journal of Chemical Information and Computer Sciences. 42, 3, S. 640-650 11 S.

    Publikation: Beiträge in Zeitschriften › Zeitschriftenaufsätze › Forschung › begutachtet

  5. Organic Synthesis – Art or Science?

    Rücker, C., Rücker, G. & Bertz, S. H., 03.05.2004, in: Journal of Chemical Information and Computer Sciences. 44, 2, S. 378-386 9 S.

    Publikation: Beiträge in Zeitschriften › Zeitschriftenaufsätze › Forschung › begutachtet

  6. QSPR Using MOLGEN-QSPR: The challenge of fluoroalkane boiling points

    Rücker, C., Meringer, M. & Kerber, A., 01.2005, in: Journal of Chemical Information and Modeling. 45, 1, S. 74-80 7 S.

    Publikation: Beiträge in Zeitschriften › Zeitschriftenaufsätze › Forschung › begutachtet

  7. y-Randomization and its variants in QSPR/QSAR

    Rücker, C., Rücker, G. & Meringer, M., 11.2007, in: Journal of Chemical Information and Modeling. 47, 6, S. 2345-2357 13 S.

    Publikation: Beiträge in Zeitschriften › Zeitschriftenaufsätze › Forschung › begutachtet

  8. Molecules in silico: A graph description of chemical reactions

    Kerber, A., Laue, R., Meringer, M. & Rücker, C., 29.05.2007, in: Journal of Chemical Information and Modeling. 47, 3, S. 805-817 13 S.

    Publikation: Beiträge in Zeitschriften › Zeitschriftenaufsätze › Forschung › begutachtet

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