molvision/Clintox-V-SMILES-0
收藏Hugging Face2025-10-21 更新2025-10-25 收录
下载链接:
https://hf-mirror.com/datasets/molvision/Clintox-V-SMILES-0
下载链接
链接失效反馈官方服务:
资源简介:
Clintox-V-SMILES训练数据集包含了与Clintox相关化合物的分子数据和视觉表示。数据集中的每个样本包括一个与分子相关的问题、对应的答案、目标分子的SMILES表示、采样方法、样本编号、样本重复次数以及一个由SMILES表示生成的分子结构图像。总样本数为1190个,图像格式为PIL Image (RGB),大小为300x300像素。
The Clintox-V-SMILES Train Dataset contains molecular data with visual representations for Clintox related compounds. Each sample in the dataset includes a question related to the molecule, the corresponding answer, the SMILES representation of the target molecule, the sampling method, the sample number, the sample repetition, and a molecular structure image generated from the SMILES representation. The total number of samples is 1190, with the image format being PIL Image (RGB) and the size being 300x300 pixels.
提供机构:
molvision



