CompTox Chemicals Dashboard Metadata Files for Integration with MetFrag
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下载链接：
https://figshare.com/articles/dataset/CompTox_Chemicals_Dashboard_Metadata_Files_for_Integration_with_MetFrag/7525199
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资源简介：
The integration of metadata files from the CompTox Chemicals
Dashboard with the online version of the MetFrag in silico fragmenter
has previously been discussed in the paper ““MS-Ready” structures for
non-targeted high-resolution mass spectrometry screening studies” by McEachran et
al. (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.
创建时间：
2018-12-27
