Repositories list

• rdm-for-chemists

  Public
  Research Data Management for Chemists Workshop Material

  Other

  •0•1•0•0•Updated Mar 31, 2026Mar 31, 2026

• .github

  Public
  0•0•0•0•Updated Mar 27, 2026Mar 27, 2026

• intro_to_ml_for_chemists

  Public
  Workshop material for Intro to ML for Chemists

  Jupyter Notebook

  •

  The Unlicense

  •0•0•0•0•Updated Mar 27, 2026Mar 27, 2026

• aichemy-data-pipelines

  Public
  Automated processing of Mass Spec

  Python

  •

  BSD 3-Clause "New" or "Revised" License

  •0•0•0•0•Updated Mar 25, 2026Mar 25, 2026

• aichemy-research-data

  Public
  Links to research data from the AIchemy hub

  Python

  •1•0•0•0•Updated Mar 4, 2026Mar 4, 2026

• chem-ai-resources

  Public
  Learning and programming resources for AI in Chemistry and Materials Science

  Python

  •1•0•0•0•Updated Mar 3, 2026Mar 3, 2026

• docs

  Public
  1•0•33•0•Updated Jun 3, 2025Jun 3, 2025

• nomad-server

  Public
  Server side code for NOMAD system

  JavaScript

  •

  GNU Affero General Public License v3.0

  •3•0•0•0•Updated Apr 29, 2025Apr 29, 2025

• datalab-api-demo

  Public
  Demo usage of the datalab api to add automated experimental samples to datalab

  Python

  •0•1•0•0•Updated Apr 16, 2025Apr 16, 2025

• datalab

  Public
  datalab is a place to store experimental data and the connections between them.

  Python

  •

  MIT License

  •27•0•0•0•Updated Apr 15, 2025Apr 15, 2025

• aitomic

  Public
  Make AI in chemistry simple!

  Python

  •

  MIT License

  •1•2•1•0•Updated Apr 3, 2025Apr 3, 2025