CompTox Chemicals Dashboard Metadata Files for Integration with MetFrag
收藏DataCite Commons2025-06-01 更新2025-04-16 收录
下载链接：
https://epa.figshare.com/articles/CompTox_Chemicals_Dashboard_Metadata_Files_for_Integration_with_MetFrag/7525199/2
下载链接
链接失效反馈官方服务：
资源简介：
The integration of metadata files from the CompTox Chemicals Dashboard with the online version of the MetFrag <i>in silico</i> fragmenter has previously been discussed in the paper ““MS-Ready” structures for non-targeted high-resolution mass spectrometry screening studies” by McEachran <i>et al. </i>(link to https://doi.org/10.1186/s13321-018-0299-2). For local installations of MetFrag we have provided here downloadable versions of these metadata files.
提供机构：
The United States Environmental Protection Agency’s Center for Computational Toxicology and Exposure
创建时间：
2019-07-15
