cmiles
importedtherapeutics/cmiles
Generate canonical molecule identifiers for quantum chemistry database
Machine-generated from the listed sources and not yet reviewed by a human.
- Category
- Therapeutics
- Subcategory
- unknown
- License
- MIT(osi)
- Status
- dormant
- Maturity
- deployed
- Organization
- openforcefield
- Country
- unknown
- Homepage
- cmiles.readthedocs.io
- Repository
- github.com/openforcefield/cmiles
- Documentation
- unknown
- Tags
- cheminformatics · database · forcefield · forcefield-parameterization · quantum-chemistry
- Regulatory
- unknown
Top contributors by commit count, from the project’s public repository. Avatars are served by their origin, not stored here. To be removed from this list, open an issue.
Computed from shared tags, weighted so a rare tag counts for more than a common one. These are suggestions, not curated relationships.
- aqmecheminformatics · quantum-chemistry
Automated Quantum Mechanical Environments (AQME) offers transparent and reproducible workflows available for Jupyter Notebooks and command lines, including: 1) RDKit- and CREST-based conformer…
- aqmlcheminformatics · quantum-chemistry
Amons-based quantum machine learning for quantum chemistry
- psikitcheminformatics · quantum-chemistry
psi4+RDKit
- qmllibcheminformatics · quantum-chemistry
Quantum machine learning (QML) molecular representations and core functions
- mcpcheminformatics · database
MCP server for 200M+ patents, scientific literature, chemistry and pharma records. Search prior art and R&D intelligence powered by PatSnap's proprietary databases via Claude, Cursor and…
- stk-vischeminformatics · database
A cross-platform application for visualization of molecular databases.
- api.github.com/repos/openforcefield/cmilesretrieved 2026-08-05 · via github-api
Machine-imported from GitHub search. Last push 2021-05-17, 23 stars, license reported as MIT. Category and schematic were assigned by keyword heuristics and are unreviewed.
Not yet verified by a human. Correct this record →
/v1/entries/4.json→ .entries["cmiles"]
Entries are sharded 64 ways by a stable hash of the id, so a consumer can find any record without an index.