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5 works

Work: Total and local (atom and atom type) molecular quadratic indices: significance interpretation, comparison to other molecular descriptors, and QSPR/QSAR applications

  1. Atom‐Based 2D Quadratic Indices in Drug Discovery of Novel Tyrosinase Inhibitors: Results of <i>In Silico</i> Studies Supported by Experimental Results

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

    ArticleComputational Drug Discovery MethodsQSAR & Combinatorial Science20061 citations
    ABI

  2. Prediction of Tyrosinase Inhibition Activity Using Atom‐Based Bilinear Indices

    Yovani Marrero‐Ponce, Mahmud Tareq Hassan Khan, Gerardo M. Casañola‐Martín +4

    ArticleComputational Drug Discovery MethodsChemMedChem20070 citations
    ABI

  3. 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

    ArticleComputational Drug Discovery MethodsJournal of Computer-Aided Molecular Design20070 citations
    ABI

  4. A Quantitative Structure - Permittivity Relationship Study of a Series of Polymers

    Yevhenii Zhuravskyi, Kweeni Iduoku, Meade Erickson +7

    PreprintPolymer crystallization and propertiesChemRxiv20230 citations
    ABI

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

    Yevhenii Zhuravskyi, Kweeni Iduoku, Meade Erickson +8

    ArticleDielectric materials and actuatorsACS Materials Au20240 citations
    ABI