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  1. Article

    Open Access

    MLatom 2: An Integrative Platform for Atomistic Machine Learning

    Atomistic machine learning (AML) simulations are used in chemistry at an ever-increasing pace. A large number of AML models has been developed, but their implementations are scattered among different packages,...

    Pavlo O. Dral, Fuchun Ge, Bao-**n Xue, Yi-Fan Hou… in Topics in Current Chemistry (2021)

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