Repositories list

• chemotion-converter-app

  Public
  converterchemistryanalytics+ 1

  converterchemistryanalyticsfair-data

  CSS

  •

  GNU Affero General Public License v3.0

  •55 forks•55 stars•1111 issues•44 pull requests•Updated Jul 22, 2026Jul 22, 2026

• chemotion_ELN

  Public
  Electronic Lab Notebook

  rdmelnfair-data+ 1

  rdmelnfair-datasmart-lab

  JavaScript

  •

  GNU Affero General Public License v3.0

  •6969 forks•187187 stars•424424 issues•110110 pull requests•Updated Jul 22, 2026Jul 22, 2026

• DELFIN

  Public
  Python

  •

  Other

  •00 forks•77 stars•00 issues•00 pull requests•Updated Jul 22, 2026Jul 22, 2026

• chemotion_saurus

  Public
  javascriptmarkdowndocumentation+ 1

  javascriptmarkdowndocumentationdocumentation-website

  JavaScript

  •5050 forks•11 star•3535 issues•1414 pull requests•Updated Jul 22, 2026Jul 22, 2026

• chemotion-converter-client

  Public
  JavaScript

  •

  GNU Affero General Public License v3.0

  •11 fork•11 star•11 issue•44 pull requests•Updated Jul 22, 2026Jul 22, 2026

• chem-spectra-app

  Public
  A backend web service provides NMR/IR/MS processing for jcamp/RAW/mzML files.

  Python

  •

  MIT License

  •99 forks•1616 stars•1414 issues•99 pull requests•Updated Jul 21, 2026Jul 21, 2026

• OpenStats

  Public
  OpenStats is a shiny app offering many statistical methods (visualisation with ggplot2, t-test, aov, correlations etc.).

  visualizationdata-sciencedata+ 3

  visualizationdata-sciencedataggplot2shinyrstats

  R

  •

  GNU General Public License v3.0

  •11 fork•88 stars•1616 issues•00 pull requests•Updated Jul 20, 2026Jul 20, 2026

• react-spectra-editor

  Public
  An editor to View and Edit Chemical Spectra data (NMR, IR and MS).

  JavaScript

  •

  MIT License

  •66 forks•1616 stars•2222 issues•88 pull requests•Updated Jul 20, 2026Jul 20, 2026

• ChemistryKnowledgeBase

  Public
  a project based on semantic media wiki - enriched with chemistry toolkits

  PHP

  •22 forks•11 star•2020 issues•00 pull requests•Updated Jul 4, 2026Jul 4, 2026

• nmrglue

  Public
  A module for working with NMR data in Python

  Python

  •

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

  •103103 forks•00 stars•00 issues•11 pull request•Updated Jul 3, 2026Jul 3, 2026

• shuttlebuilder

  Public
  JavaScript

  •11 fork•00 stars•00 issues•00 pull requests•Updated Jul 3, 2026Jul 3, 2026

• sablon

  Public
  Ruby Document Template Processor based on docx templates and Mail Merge fields.

  Ruby

  •

  MIT License

  •137137 forks•11 star•00 issues•00 pull requests•Updated Jun 26, 2026Jun 26, 2026

• openbabel-gem

  Public
  Ruby GEM for openbabel

  Ruby

  •88 forks•00 stars•00 issues•00 pull requests•Updated Jun 25, 2026Jun 25, 2026

• inchi-gem

  Public
  Ruby wrapper for InChI v1.06

  Ruby

  •

  GNU Lesser General Public License v2.1

  •11 fork•00 stars•00 issues•00 pull requests•Updated Jun 23, 2026Jun 23, 2026

• BinaryParser

  Public
  binary parser

  Python

  •

  GNU General Public License v3.0

  •11 fork•00 stars•99 issues•00 pull requests•Updated Jun 9, 2026Jun 9, 2026

• chem-spectra-client

  Public
  ChemSpectra client side server.

  JavaScript

  •

  MIT License

  •55 forks•1010 stars•22 issues•22 pull requests•Updated May 29, 2026May 29, 2026

• reaction-svg-composer

  Public
  TypeScript

  •00 forks•00 stars•00 issues•55 pull requests•Updated May 22, 2026May 22, 2026

• reaction-process-editor

  Public
  UI for Reaction process editor

  JavaScript

  •

  Other

  •00 forks•00 stars•00 issues•00 pull requests•Updated Apr 21, 2026Apr 21, 2026

• smart-add

  Public
  TypeScript

  •00 forks•22 stars•00 issues•22 pull requests•Updated Apr 21, 2026Apr 21, 2026

• chemotion-converter-profiles

  Public
  Profiles and test files for the chemotion converter

  converterchemistryanalytics+ 1

  converterchemistryanalyticsfair-data

  HTML

  •

  GNU Affero General Public License v3.0

  •00 forks•00 stars•00 issues•00 pull requests•Updated Mar 13, 2026Mar 13, 2026

• chemotion_REPO

  Public
  Repository for samples, reactions and related research data

  metadatarepositorydataset+ 5

  metadatarepositorydatasetfairrdmdata-repositoryfair-datanfdi4chem

  JavaScript

  •

  GNU Affero General Public License v3.0

  •55 forks•2020 stars•3333 issues•1010 pull requests•Updated Mar 6, 2026Mar 6, 2026

• shuttle

  Public
  File Watcher Builder

  Go

  •11 fork•00 stars•00 issues•00 pull requests•Updated Feb 3, 2026Feb 3, 2026

• Thermosimfit

  Public
  Optimizing Unknown Parameters in Algebraic Systems for Thermodynamic Bindings (https://complat.github.io/Thermosimfit/)

  optimizationthermodynamicsrstats+ 1

  optimizationthermodynamicsrstatsparticle-swarm-optimization

  R

  •00 forks•44 stars•1313 issues•00 pull requests•Updated Nov 28, 2025Nov 28, 2025

• Ants

  Public
  C

  •11 fork•11 star•00 issues•00 pull requests•Updated Aug 14, 2025Aug 14, 2025

• rinchi-gem

  Public
  Ruby

  •22 forks•00 stars•00 issues•00 pull requests•Updated Jun 24, 2025Jun 24, 2025

• water-solubility-prediction

  Public
  Jupyter Notebook

  •11 fork•66 stars•11 issue•00 pull requests•Updated Apr 23, 2025Apr 23, 2025

• PubChem_datasourcing

  Public
  Jupyter Notebook

  •00 forks•00 stars•00 issues•00 pull requests•Updated Apr 21, 2025Apr 21, 2025

• chemotion-builder

  Public
  Monorepo containing everything you need to build and run Chemotion in a dockerized environment.

  Dockerfile

  •1212 forks•00 stars•11 issue•00 pull requests•Updated Oct 29, 2024Oct 29, 2024

• react-svg-file-zoom-pan

  Public
  A package displaying an external SVG file/string as react.js component with zoom & pan.

  JavaScript

  •

  GNU General Public License v2.0

  •22 forks•77 stars•33 issues•44 pull requests•Updated Sep 28, 2024Sep 28, 2024

• ir_analysis

  Public
  Python

  •11 fork•44 stars•00 issues•00 pull requests•Updated Aug 14, 2024Aug 14, 2024