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  1. solvent solvent Public

    预测提升钙钛矿MAPbI3的多元溶剂分子,使用二分类

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    Word2vec,textual descriptor

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  3. csv_template_for-NJmat csv_template_for-NJmat Public

    csv template of case 1~4

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    红外模拟

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    rfe 二分类 PCE 阈值为20%