Welcome to DeepMASS

DeepMASS is an innovative software tool providing a robust solution for annotating and discovering metabolites within complex biological systems. Its foundation lies in a sophisticated deep-learning-based semantic similarity model, seamlessly connecting mass spectra to structurally related compounds. This connection effectively maps the chemical space of the unknown metabolites. DeepMASS maximizes the utility of mass spectrometry big data, positioning itself for further development as data scales continue to expand.

Getting Started

Using DeepMASS locally, please refer the document, and the following video for quick start.

Web Server

Using DeepMASS with web server, we made a easy-to-use web UI interface, check it out!

Web Server

Sources on GitHub

Source codes is under active development at GitHub.

Changelog

• Version 0.99.0, First Release, Oct 16th, 2023
• Version 0.99.1, Update molecular database, Jan 17th, 2024
• Version 0.99.2, Update model with NIST23, Jun 5th, 2024

Citations

Comming soon ...