Spony/PubChem_filtered
收藏Hugging Face2025-02-07 更新2025-08-30 收录
下载链接：
https://hf-mirror.com/datasets/Spony/PubChem_filtered
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资源简介：
PubChem数据集是从PubChem数据库中筛选出来的分子数据集。该数据集中的所有分子都包含氢原子，去除了不连续的片段，并且只保留了具有超过100个原子的分子。
This dataset contains molecules from the PubChem database, with the following filtering criteria applied: All molecules include hydrogen atoms, disconnected fragments have been removed, and only molecules with more than 100 atoms have been retained.
提供机构：
Spony
