librarian

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Record description

Title: librarian
DOI: https://doi.org/10.82595/scilifelab.68cx0-7xz87
Description: Librarian is an open-access, web-based application for building and sharing high-quality MS² spectral libraries for nontarget high-resolution mass spectrometry. It provides a streamlined, end-to-end workflow to retrieve and harmonize chemical metadata from PubChem, design compound mixtures for HRMS acquisition, and assemble standardized, metadata-rich MS² records ready for deposition in public repositories such as MassBank. Designed to lower technical barriers, Librarian is modular, interoperable with common HRMS preprocessing tools, and supports scalable, community-driven expansion of open spectral libraries for metabolomics, exposomics, and environmental research.
URL: https://librarian.serve.scilifelab.se
Source code: https://github.com/jahlwe/streamlit-librarian
Docker image: ghcr.io/jahlwe/streamlit-librarian:20260621-222749
Date submitted: 2025-07-01 22:08
Date updated: 2026-06-21 22:33
Date available: 2026-03-16 22:32
Language: English