Preprint! "Inverse Design of Complex Nanoparticle Heterostructures via Deep Learning on Heterogeneous Graphs" is now on ChemRxiv. In this work, we consider the problem of applying deep learning to heterogeneous nanostructures. (1/10)
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Inverse Design of Complex Nanoparticle Heterostructures via Deep Learning on Heterogeneous Graphs
Applications of deep learning (DL) to design nanomaterials are hampered by a lack of suitable data representations and training data. We report efforts to overcome these limitations and leverage DL to...