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Gerardo M. Casañola‐Martín

10 ta ish

Department of Pharmacy, Faculty of Chemistry-Pharmacy, Central University of Las Villas, Santa Clara, 54830 Villa Clara, Cuba

  1. New tyrosinase inhibitors selected by atomic linear indices-based classification models

    Gerardo M. Casañola‐Martín, Mahmud Tareq Hassan Khan, Yovani Marrero‐Ponce +3

    MaqolaComputational Drug Discovery MethodsBioorganic & Medicinal Chemistry Letters20051 iqtibos
    ABI

  2. 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

    MaqolaComputational Drug Discovery MethodsQSAR & Combinatorial Science20061 iqtibos
    ABI

  3. A Quantitative Structure–Activity Relationship Study of the Anabolic Activity of Ecdysteroids

    Durbek Usmanov, Ugiloy Yusufovna Yusupova, В. Н. Сыров +2

    MaqolaComputational Drug Discovery MethodsComputation20251 iqtibos
    ABI

  4. In silico Discovery of Novel Tyrosinase Inhibitors using Atom Based Linear Indices

    Gerardo M. Casañola‐Martín, Yovani Marrero‐Ponce, Mahmud Khan +3

    MaqolaComputational Drug Discovery Methods20060 iqtibos
    ABI

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

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

    MaqolaComputational Drug Discovery MethodsChemMedChem20070 iqtibos
    ABI

  6. 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

  7. Stability Constant and Potentiometric Sensitivity of Heavy Metal–Organic Fluorescent Compound Complexes: QSPR Models for Prediction and Design of Novel Coumarin-like Ligands

    Phan Thi Diem-Tran, Tue-Tam Ho, Nguyen-Van Tuan +10

    MaqolaComputational Drug Discovery MethodsToxics20230 iqtibos
    ABI

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

    Yevhenii Zhuravskyi, Kweeni Iduoku, Meade Erickson +7

    PreprintPolymer crystallization and propertiesChemRxiv20230 iqtibos
    ABI

  9. 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

  10. Similarity Analysis of Computer-Generated and Commercial Libraries for Targeted Biocompatible Coded Amino Acid Replacement

    Markus Meringer, Gerardo M. Casañola‐Martín, Bakhtiyor Rasulev +1

    MaqolaChemical Synthesis and AnalysisInternational Journal of Molecular Sciences20240 iqtibos
    ABI