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    HT-SuMD: making molecular dynamics simulations suitable for fragment-based screening. A comparative study with NMR

    HT-SuMD: making molecular dynamics simulations suitable for fragment-based screening. A comparative study with NMR by Francesca Ferrari, Maicol Bissaro, Simone Fabbian, Jessica De Almeida Roger, Stefano Mammi, Stefano Moro, Massimo Bellanda, Mattia Sturlese

    Published 2021
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