MS2Query - machine learning assisted library querying of MS/MS spectra
☆57Nov 6, 2025Updated 7 months ago
Alternatives and similar repositories for ms2query
Users that are interested in ms2query are comparing it to the libraries listed below. We may earn a commission when you buy through links labeled 'Ad' on this page.
Sorting:
- The Mass Spec Query Language (MassQL) is a domain specific language meant to be a succinct way to express a query in a mass spectrometry …☆57Apr 23, 2026Updated last month
- SIRIUS is a software for discovering a landscape of de-novo identification of metabolites using tandem mass spectrometry. This repository…☆153Jun 1, 2026Updated last week
- FBMN-STATS: A hitchhiker's guide to statistical analysis of Feature-based Molecular Networks☆49Jun 23, 2025Updated 11 months ago
- Python library for processing (tandem) mass spectrometry data and for computing spectral similarities.☆258Updated this week
- Word2Vec based similarity measure of mass spectrometry data.☆85Nov 10, 2025Updated 6 months ago
- Wordpress hosting with auto-scaling - Free Trial Offer • AdFully Managed hosting for WordPress and WooCommerce businesses that need reliable, auto-scalable performance. Cloudways SafeUpdates now available.
- ☆12Feb 5, 2024Updated 2 years ago
- A bioinformatic tool facilitating automated in-source fragmentation identification☆10Sep 6, 2022Updated 3 years ago
- ☆11Feb 20, 2026Updated 3 months ago
- ☆27Mar 20, 2026Updated 2 months ago
- Spectral entropy for mass spectrometry data.☆37Updated this week
- ☆12Jan 16, 2025Updated last year
- a python package for molecular formula analysis in MS-based small molecule studies☆35Jan 28, 2026Updated 4 months ago
- mzmine source code repository☆276Jun 3, 2026Updated last week
- Bottom-up MS/MS interrogation & Experiment-specific global annotation☆32Dec 19, 2024Updated last year
- Deploy to Railway using AI coding agents - Free Credits Offer • AdUse Claude Code, Codex, OpenCode, and more. Autonomous software development now has the infrastructure to match with Railway.
- R package for optimized LC-MS spectra processing☆30May 18, 2026Updated 3 weeks ago
- MS2Tox is a machine learning tool for predicting ecotoxicity of unidentified chemicals in water by nontarget LC/HRMS☆16Jan 8, 2026Updated 5 months ago
- A global network optimization approach for untargeted LC-MS metabolomics data annotation and metabolite discovery☆51Aug 28, 2023Updated 2 years ago
- Improve the accuracy of database search by using BERT to embed MS/MS reasonably☆20Oct 15, 2024Updated last year
- Encoding MS/MS spectra using formula transformers for inferring molecular properties☆79Jun 5, 2024Updated 2 years ago
- Metabolomics software for database-assisted deconvolution of MS/MS spectra☆20Jan 24, 2024Updated 2 years ago
- data processing for MS-based metabolomics☆15May 28, 2026Updated last week
- Tool for reliability assessment of omics peprocessing☆11Jan 13, 2026Updated 4 months ago
- Libraries for fine isotopic structure calculator.☆43Jun 2, 2026Updated last week
- Managed Kubernetes at scale on DigitalOcean • AdDigitalOcean Kubernetes includes the control plane, bandwidth allowance, container registry, automatic updates, and more for free.
- Ms2 basEd saMple vectOrization (memo) package☆17Jun 13, 2023Updated 2 years ago
- Predicting tandem mass spectra from molecules☆142May 22, 2026Updated 2 weeks ago
- https://taxonomicallyinformedannotation.github.io/tima☆16Updated this week
- Untargeted metabolomics workflow for large-scale data processing and analysis implemented in Snakemake☆32Jan 5, 2025Updated last year
- asari, metabolomics data preprocessing☆64Updated this week
- Molecular formula discovery via bottom-up MS/MS interrogation☆13Sep 4, 2024Updated last year
- ☆39Mar 16, 2026Updated 2 months ago
- A "fairly fast" ISOtope PAttern Calculator for Python☆13Sep 27, 2023Updated 2 years ago
- Deep learning similarity measure for comparing MS/MS spectra with respect to their chemical similarity☆85Apr 20, 2026Updated last month
- GPU virtual machines on DigitalOcean Gradient AI • AdGet to production fast with high-performance AMD and NVIDIA GPUs you can spin up in seconds. The definition of operational simplicity.
- ☆34Dec 12, 2024Updated last year
- Annotation of in source LC/MS data☆12Oct 19, 2024Updated last year
- eMetabolomics project: Mass Annotation based on in silico Generated Metabolites☆17Oct 30, 2022Updated 3 years ago
- Dashboard for analysis of liquid chromatography (tandem) mass spectrometry data.☆34Apr 25, 2026Updated last month
- R Interface to the ClassyFire REST API☆14May 20, 2026Updated 2 weeks ago
- Package for analyzing MS with Python☆10Jan 11, 2018Updated 8 years ago
- ☆16Jul 20, 2022Updated 3 years ago