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    • Martin Šícho

    7 results in Authors: Martin Šícho

    Category: Theoretical and Computational Chemistry
    ,
    Working Paper
    , Title:

    Generate What You Can Make: Achieving in-house synthesizability with readily available resources in de novo drug design

    , Authors: Alan Kai Hassen, Martin Sicho, Yorick J. van Aalst, Mirjam C.W. Huizenga, Darcy N.R. Reynolds, Sohvi Luukkonen, Andrius Bernatavicius, Djork-Arné Clevert, Antonius P.A. Janssen, Gerard J.P. van Westen, Mike Preuss
    Version 1 posted 05 March 2024
    890
    Downloads
    1
    Citations
    Category: Theoretical and Computational Chemistry
    ,
    Working Paper
    , Title:

    QSPRpred: a Flexible Open-Source Quantitative Structure-Property Relationship Modelling Tool

    , Authors: Helle W. van den Maagdenberg, Martin Šícho, David Alencar Araripe, Sohvi Luukkonen, Linde Schoenmaker, Michiel Jespers, Olivier J. M. Béquignon, Marina Gorostiola González, Remco L. van den Broek, Andrius Bernatavicius, J. G. Coen van Hasselt, Piet. H. van der Graaf, Gerard J. P. van Westen
    Version 1 posted 05 March 2024
    456
    Downloads