AdrianM0/SMILES-to-IUPAC-BOOTSTRAP-ROUND-19
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资源简介:
该数据集包含了SMILES和IUPAC两种字符串类型的化学分子表示,分为训练集和验证集两部分,共包含14320个示例。提供了默认配置文件,指定了数据文件的路径。
The dataset includes SMILES and IUPAC string representations of chemical molecules, divided into training and validation sets, containing a total of 14320 examples. A default configuration file is provided, specifying the path to the data files.
提供机构:
AdrianM0


