Collaborative Estrogen Receptor Activity Prediction Project (CERAPP) Data: Training Set
收藏DataCite Commons2020-08-30 更新2025-04-16 收录
下载链接：
https://epa.figshare.com/articles/Collaborative_Estrogen_Receptor_Activity_Prediction_Project_CERAPP_Data_Training_Set/6062563/1
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资源简介：
Data and supplemental files from CERAPP (A large-scale modeling project). CERAPP combined multiple models developed in collaboration with 17 groups in the United States and Europe to predict estrogen receptor activity of a common set of 32464 chemical structures. Quantitative structure-activity relationship models and docking approaches were employed to build a total of 40 categorical and 8 continuous models for binding; agonist; and antagonist ER activity. This link provides the CERAPP Training Set.
提供机构：
The United States Environmental Protection Agency’s Center for Computational Toxicology and Exposure
创建时间：
2018-03-29
