sfboisvert/Simeonov2008

该数据集包含两个主要特征：CID（化合物标识符，整数类型）和smiles（化学物质的简化分子输入线性表达式，字符串类型）。数据集被分割为训练集，共有6743个示例，占用372984字节。整个数据集的大小为372984字节，下载大小为192350字节。The dataset includes two main features: CID (Compound Identifier, integer type) and smiles (Simplified Molecular Input Line Entry System, string type). The dataset is split into a training set with a total of 6743 examples, occupying 372984 bytes. The overall size of the dataset is 372984 bytes, with a download size of 192350 bytes.