Showing 1 - 4 results of 4 for search 'Aniket Magarkar', query time: 0.01s Refine Results
  1. 1
    Moldrug algorithm for an automated ligand binding site exploration by 3D aware molecular enumerations

    Moldrug algorithm for an automated ligand binding site exploration by 3D aware molecular enumerations by Alejandro Martínez León, Benjamin Ries, Jochen S. Hub, Aniket Magarkar

    Published 2025-05-01
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  2. 2
    Editorial: Methods in predictive toxicology 2023

    Editorial: Methods in predictive toxicology 2023 by Sankalp Jain, Serena Manganelli, Vitalina Gryshkova, Maria Armanda Rodrigues, Aniket Magarkar

    Published 2025-02-01
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  3. 3
    Structural basis for lipid-mediated activation of G protein-coupled receptor GPR55

    Structural basis for lipid-mediated activation of G protein-coupled receptor GPR55 by Tobias Claff, Rebecca Ebenhoch, Jörg T. Kley, Aniket Magarkar, Herbert Nar, Dietmar Weichert

    Published 2025-02-01
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  4. 4
    Narrowing the gap between machine learning scoring functions and free energy perturbation using augmented data

    Narrowing the gap between machine learning scoring functions and free energy perturbation using augmented data by Ísak Valsson, Matthew T. Warren, Charlotte M. Deane, Aniket Magarkar, Garrett M. Morris, Philip C. Biggin

    Published 2025-02-01
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