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    • QSPR modelling
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    2 results in QSPR modelling in Keywords: QSPR modelling

    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
    569
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    1
    Citations
    Category: Materials Science
    ,
    Working Paper
    , Title:

    P2MAT: A machine learning (ML) driven software for Property Prediction of MATerial

    , Authors: Methun Kamruzzaman, Alexander Landera, Nalini Chulliyil Menon, Mark D. Allendorf, Kunal Poorey
    Version 1 posted 16 December 2024
    172
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