c3p


Namec3p JSON
Version 0.5.0 PyPI version JSON
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home_pageNone
SummaryCHEBI Classification Programs
upload_time2025-08-23 20:15:03
maintainerNone
docs_urlNone
authorChris Mungall
requires_python<4.0,>=3.9
licenseNone
keywords
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bugtrack_url
requirements No requirements were recorded.
Travis-CI No Travis.
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            # C3PO: CHEBI Classification Programs Ontology

Learning classification programs to categorize SMILES strings into [CHEBI](https://www.ebi.ac.uk/chebi/) classes.

![logo](docs/assets/c3p-small.png)

- Documentation: [c3p docs](https://chemkg.github.io/c3p/)
- [Slides](https://docs.google.com/presentation/d/1VJvRptWu6FhTTmZGM4X3ymbxn9JwYPWDUp9djfMfDao/edit#slide=id.p)

## Usage

```bash
pip install c3p
c3p -x "CC1=CC=C(C=C1)C1=C(C#N)C2=NC3=CC=CC=C3N2C(N)=C1C#N"
```

## Learning Programs

All code in Notebook

Example [generated programs](c3p/programs/)

## Guide to paper




            

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