Dataset containing over 7,400 activity cliffs produced by 10 widely used single-atom modifications.
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下载链接：
https://zenodo.org/record/13845968
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资源简介：
A dataset containing 7,407 activity cliffs generated by single-atom modifications is provided. For each compound, its ChEMBL ID and atom modifications are included, along with PDB IDs when available
创建时间：
2024-09-27
