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7 ta ish

Ish: Topological Indices and Related Descriptors in QSAR and QSPR

  1. Comparison of QSPR Models Based on Hydrogen-Filled Graphs and on Graphs of Atomic Orbitals

    Andrey A. Toropov, Alla P. Toropova, İvan Gutman

    MaqolaComputational Drug Discovery MethodsUniversity of Zagreb University Computing Centre (SRCE)20052 iqtibos
    ABI

  2. QSPR modeling of the water solubility of diverse functional aliphatic compounds by optimization of correlation weights of local graph invariants

    Kunal Roy, Andrey A. Toropov

    MaqolaComputational Drug Discovery MethodsJournal of Molecular Modeling20051 iqtibos
    ABI

  3. Structure-toxicity relationships of nitroaromatic compounds

    Olexandr Isayev, Bakhtiyor Rasulev, Leonid Gorb +1

    MaqolaComputational Drug Discovery MethodsMolecular Diversity20061 iqtibos
    ABI

  4. QSPR modeling of the half-wave potentials of benzoxazines by optimal descriptors calculated with the SMILES

    Andrey A. Toropov, Karel Nesměrák, Ivan Raška +2

    MaqolaPhenothiazines and Benzothiazines Synthesis and ActivitiesComputational Biology and Chemistry20061 iqtibos
    ABI

  5. Bond-based 2D TOMOCOMD-CARDD approach for drug discovery: aiding decision-making in ‘in silico’ selection of new lead tyrosinase inhibitors

    Yovani Marrero‐Ponce, Mahmud Tareq Hassan Khan, Gerardo M. Casañola‐Martín +5

    MaqolaComputational Drug Discovery MethodsJournal of Computer-Aided Molecular Design20070 iqtibos
    ABI

  6. O Zagrebaèkim indeksima

    İvan Gutman

    MaqolaGraph theory and applications20100 iqtibos
    ABI

  7. Quantitative Structure─Permittivity Relationship Study of a Series of Polymers

    Yevhenii Zhuravskyi, Kweeni Iduoku, Meade Erickson +8

    MaqolaDielectric materials and actuatorsACS Materials Au20240 iqtibos
    ABI