https://github.com/rvianello/chemicalite

An SQLite extension for chemoinformatics applications.
https://github.com/rvianello/chemicalite

rdkit sqlite

Last synced: 2 months ago
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An SQLite extension for chemoinformatics applications.

• Host: GitHub
• URL: https://github.com/rvianello/chemicalite
• Owner: rvianello
• License: bsd-3-clause
• Created: 2013-04-01T19:08:41.000Z (about 13 years ago)
• Default Branch: master
• Last Pushed: 2025-10-17T08:49:20.000Z (7 months ago)
• Last Synced: 2025-11-10T04:27:30.172Z (6 months ago)
• Topics: rdkit, sqlite
• Language: C++
• Homepage: https://chemicalite.readthedocs.org/en/latest/
• Size: 469 KB
• Stars: 60
• Watchers: 4
• Forks: 8
• Open Issues: 5
• Metadata Files:
  • Readme: README.md
  • Changelog: CHANGELOG.md
  • License: LICENSE.txt

Awesome Lists containing this project

README

          
ChemicaLite

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An SQLite database extension for chemoinformatics applications. Store molecules and fingerprints, compute descriptors, run chemical queries on a chemical database.