Skip to content

Pull requests: hsiaoyi0504/awesome-cheminformatics

New pull request New
18 Open 23 Closed
18 Open 23 Closed
Author
Filter by author
Loading
Label
Filter by label
Loading
Use alt + click/return to exclude labels
or ⇧ + click/return for logical OR
Projects
Filter by project
Loading
Milestones
Filter by milestone
Loading
Reviews
Filter by reviews
No reviews Review required Approved review Changes requested
Assignee
Filter by who’s assigned
Assigned to nobody Loading
Sort
Sort by
Newest Oldest Most commented Least commented Recently updated Least recently updated Best match
Most reactions
👍 👎 😄 🎉 😕 ❤️ 🚀 👀

Pull requests list

Add posecheck-fast
#89 opened Jun 13, 2026 by SergeiNikolenko Loading…
Add Bento
#88 opened Jun 13, 2026 by SergeiNikolenko Loading…
Add Matcha
#87 opened Jun 13, 2026 by SergeiNikolenko Loading…
Add HEDGEHOG
#86 opened Jun 13, 2026 by SergeiNikolenko Loading…
Add Burrete
#85 opened Jun 13, 2026 by SergeiNikolenko Loading…
Add chematic to General Purpose libraries
#83 opened Jun 7, 2026 by kent-tokyo Loading…
Add Spraay x402 Gateway PubChem endpoints
#81 opened Jun 6, 2026 by plagtech Loading…
Add CovaSyn MCP to Web APIs section
#80 opened May 25, 2026 by oliverkraft93-ops Loading…
Add stratosampler to Machine Learning libraries
#79 opened Apr 29, 2026 by rubbs14 Loading…
Add PharmaCore — Apple Silicon-native AI drug discovery
#78 opened Apr 20, 2026 by reacherwu Loading…
Add MolParetoLab to Visualization applications
#75 opened Mar 17, 2026 by IlkhamFY Loading…
Add Dis-Solved BBB predictor and ADMET toolkit
#74 opened Mar 15, 2026 by abinittio Loading…
Add USDA Phytochemical Database (enriched with ClinicalTrials + ChEMBL + patent data)
#73 opened Mar 11, 2026 by wirthal1990-tech Loading…
2
Add MolBuilder - pure-Python molecular engineering toolkit
#72 opened Feb 25, 2026 by Taylor-C-Powell Loading…
Add ChemIllusion to the list of tools
#70 opened Nov 30, 2025 by scottmreed Loading…
Added Scikit-Fingerprints to Molecular Descriptors section
#69 opened Oct 2, 2025 by kamilm Loading…
Update README.md
#67 opened Feb 19, 2025 by jak713 Loading…
Added ChemicalX and Pytorch Geometric Temporal
#55 opened Dec 31, 2021 by benedekrozemberczki Loading…
1
ProTip! Mix and match filters to narrow down what you’re looking for.