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Predicting MS/MS spectra using QCxMS for the Blood Exposome Database

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Zenodo2025-05-31 更新2026-04-07 收录
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Results and parameters files for the publication on predicting QCxMS spectra for the Blood Exposome Database. A total 3939 spectra were created for 121 compounds using different parameter and protomer combinations. We found that we should be able to cover 71% of the compounds in the Blood Exposome Database using this strategy.

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2025-05-31
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