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 centric fashion.
☆57Apr 23, 2026Updated 2 months ago
Alternatives and similar repositories for MassQueryLanguage
Users that are interested in MassQueryLanguage are comparing it to the libraries listed below. We may earn a commission when you buy through links labeled 'Ad' on this page.
Sorting:
- ☆10Oct 23, 2024Updated last year
- MS2Query - machine learning assisted library querying of MS/MS spectra☆58Nov 6, 2025Updated 8 months ago
- Dashboard for analysis of liquid chromatography (tandem) mass spectrometry data.☆34Jun 10, 2026Updated last month
- Large-scale tandem mass spectrum clustering using fast nearest neighbor searching.☆36Jun 13, 2026Updated last month
- Ms2 basEd saMple vectOrization (memo) package☆17Jun 13, 2023Updated 3 years ago
- 1-Click AI Models by DigitalOcean Gradient • AdDeploy popular AI models on DigitalOcean Gradient GPU virtual machines with just a single click. Zero configuration with optimized deployments.
- Python library for processing (tandem) mass spectrometry data and for computing spectral similarities.☆261Jul 13, 2026Updated last week
- https://taxonomicallyinformedannotation.github.io/tima☆16Updated this week
- ☆15Jul 4, 2023Updated 3 years ago
- FBMN-STATS: A hitchhiker's guide to statistical analysis of Feature-based Molecular Networks☆50Jun 23, 2025Updated last year
- ☆20Jul 12, 2023Updated 3 years ago
- A workflow for metabolite identification and accurate profiling in multidimensional LC-IM-MS-DIA measurements. DOI: 10.5281/zenodo.☆16Apr 25, 2023Updated 3 years ago
- ☆40Mar 16, 2026Updated 4 months ago
- ☆12Jan 16, 2025Updated last year
- MS2Tox is a machine learning tool for predicting ecotoxicity of unidentified chemicals in water by nontarget LC/HRMS☆16Jan 8, 2026Updated 6 months ago
- Managed Database hosting by DigitalOcean • AdPostgreSQL, MySQL, MongoDB, Kafka, Valkey, and OpenSearch available. Automatically scale up storage and focus on building your apps.
- a *biosynformatic* fingerprint to explore natural product distance and diversity☆25Aug 30, 2025Updated 10 months ago
- Intrinsic Peak Analysis (IPA) pipeline for peak-picking in large-scale untargeted small molecule analysis including metabolomics, lipidom…☆16Jun 1, 2023Updated 3 years ago
- mzmine source code repository☆290Jul 13, 2026Updated last week
- SIRIUS is a software for discovering a landscape of de-novo identification of metabolites using tandem mass spectrometry. This repository…☆159Updated this week
- Mass spectral library manager☆13Apr 9, 2020Updated 6 years ago
- Untargeted metabolomics workflow for large-scale data processing and analysis implemented in Snakemake☆32Jan 5, 2025Updated last year
- Untargeted metabolomics workflow for data processing and analysis written in Jupyter notebooks (Python)☆23Nov 11, 2024Updated last year
- ☆11Apr 25, 2026Updated 2 months ago
- This repository contains training data for retention time prediction for the identification of metabolites from non-targeted LC-MS based …☆63Jul 9, 2026Updated last week
- AI Agents on DigitalOcean Gradient AI Platform • AdBuild production-ready AI agents using customizable tools or access multiple LLMs through a single endpoint. Create custom knowledge bases or connect external data.
- ☆28Nov 30, 2023Updated 2 years ago
- ☆47Mar 14, 2025Updated last year
- Molecular formula discovery via bottom-up MS/MS interrogation☆13Sep 4, 2024Updated last year
- Encoding MS/MS spectra using formula transformers for inferring molecular properties☆81Jun 5, 2024Updated 2 years ago
- ☆24Mar 26, 2025Updated last year
- MassSpecGym: A benchmark for the discovery and identification of molecules (NeurIPS 2024 Spotlight)☆144May 8, 2026Updated 2 months ago
- Word2Vec based similarity measure of mass spectrometry data.☆86Nov 10, 2025Updated 8 months ago
- CoreMS is a comprehensive mass spectrometry software framework☆68Updated this week
- ☆75Aug 21, 2024Updated last year
- 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.
- ☆16May 27, 2026Updated last month
- Convert MSP files into a database☆10May 4, 2021Updated 5 years ago
- NeatMS is an open source python package for untargeted LCMS signal labelling and filtering.☆35Aug 19, 2021Updated 4 years ago
- ☆30Feb 9, 2024Updated 2 years ago
- Unsupervised Substructure Discovery using Topic Modelling with Automated Annotation.☆21May 13, 2026Updated 2 months ago
- asari, metabolomics data preprocessing☆67Updated this week
- A Pipeline for LC-MS/MS Metabolomics Data Process and Analysis☆17Updated this week