Collection of analog series-based (ASB) scaffolds shared between ZINC, ChEMBL, and PubChem
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下载链接：
https://zenodo.org/record/1043536
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资源简介：
Analog series-based (ASB) scaffolds shared between ZINC and ChEMBL (version 22), ZINC and PubChem and all the three databases are provided as three separate files. For each ASB scaffold, the SMILES representation of ZINC compounds is provided. In addition, the number of ZINC compounds, the number and the list of targets it was annotated with is reported. A README file is also given.
创建时间：
2020-01-24
