Search Results - Koge, Daiki

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  1. 1
    Molecular Graph Indexes for Assessing Heterogeneity of Chemical Compounds

    Molecular Graph Indexes for Assessing Heterogeneity of Chemical Compounds by Wakakuri, Keisuke, Taguchi, Yudai, Koge, Daiki, Ono, Naoaki, Altaf-Ul-Amin, Md, Kanaya, Shigehiko

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  2. 2
    Data Science for QSAR for Protease activity

    Data Science for QSAR for Protease activity by Ueda, Hideki, Fukumori, Akio, Koge, Daiki, Ono, Naoaki, Altaf-Ul-Amin, Md, Kanaya, Shigehiko

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  3. 3
    Classification of metabolites by metabolic pathways concerning terpenoids, phenylpropanoids, and polyketide compounds based on machine learning

    Classification of metabolites by metabolic pathways concerning terpenoids, phenylpropanoids, and polyketide compounds based on machine learning by Koide, Yuri, Koge, Daiki, Kanaya, Shigehiko, Altaf-Ul-Amin, Md, Huang, Ming, Morita, Aki Hirai, Ono, Naoaki

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  4. 4
    Embedding of Molecular Structure Using Molecular Hypergraph Variational Autoencoder with Metric Learning

    Embedding of Molecular Structure Using Molecular Hypergraph Variational Autoencoder with Metric Learning by Koge, Daiki, Ono, Naoaki, Huang, Ming, Altaf‐Ul‐Amin, Md, Kanaya, Shigehiko

    Published in Molecular informatics
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  5. 5
    Pre-training of Molecular GNNs via Conditional Boltzmann Generator

    Pre-training of Molecular GNNs via Conditional Boltzmann Generator by Koge, Daiki, Ono, Naoaki, Kanaya, Shigehiko

    Published in arXiv.org
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  6. 6
    Variational Autoencoding Molecular Graphs with Denoising Diffusion Probabilistic Model

    Variational Autoencoding Molecular Graphs with Denoising Diffusion Probabilistic Model by Koge, Daiki, Ono, Naoaki, Kanaya, Shigehiko

    Published in arXiv.org
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