Works matching DE "MOLECULAR docking"

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    Elucidating the wedelolactone biosynthesis pathway from Eclipta prostrata (L.) L.: a comprehensive analysis integrating de novo comparative transcriptomics, metabolomics, and molecular docking of targeted proteins.

    Published in:
    Protoplasma, 2025, v. 262, n. 4, p. 815, doi. 10.1007/s00709-025-02030-8
    By:
    • Bano, Anjum;
    • Kumari, Archana;
    • Pandey, Akansha;
    • Kumar, Akhilesh;
    • Madan, Mallika;
    • Mohanta, Anshu;
    • Minj, Emma Anjali;
    • Pandey, Tushar;
    • Kanojiya, Sanjeev;
    • Pandey, Richa;
    • Shukla, Rakesh Kumar;
    • Tripathi, Vineeta
    Publication type:
    Article
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    A Comprehensive Study of the Synthesis, Spectral Characteristics, Quantum–Chemical Molecular Electron Density Theory, and In Silico Future Perspective of Novel CBr 3 -Functionalyzed Nitro-2-Isoxazolines Obtained via (3 + 2) Cycloaddition of (E)-3,3,3-Tribromo-1-Nitroprop-1-ene

    Published in:
    Molecules, 2025, v. 30, n. 10, p. 2149, doi. 10.3390/molecules30102149
    By:
    • Zawadzińska-Wrochniak, Karolina;
    • Kula, Karolina;
    • Ríos-Gutiérrez, Mar;
    • Gostyński, Bartłomiej;
    • Krawczyk, Tomasz;
    • Jasiński, Radomir
    Publication type:
    Article
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    Adsorption of Vitamin B12 on Sugarcane-Derived Activated Carbon: Fractal Isotherm and Kinetics Modelling, Electrochemistry and Molecular Modelling Studies.

    Published in:
    Molecules, 2025, v. 30, n. 10, p. 2096, doi. 10.3390/molecules30102096
    By:
    • Ranguin, Ronald;
    • Ncibi, Mohamed Chaker;
    • Jean-Marius, Corine;
    • Brouers, François;
    • Cebrián-Torrejón, Gerardo;
    • Doménech-Carbó, Antonio;
    • Souila, Steffen;
    • Sánchez-Aparicio, José-Emilio;
    • Dorce, Daniel;
    • Zapirain-Gysling, Iker;
    • Maréchal, Jean-Didier;
    • Jauregui-Haza, Ulises;
    • Gaspard, Sarra
    Publication type:
    Article
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