c3p

Name	c3p JSON
Version	0.5.0 JSON
	download
home_page	None
Summary	CHEBI Classification Programs
upload_time	2025-08-23 20:15:03
maintainer	None
docs_url	None
author	Chris Mungall
requires_python	<4.0,>=3.9
license	None
keywords
VCS
bugtrack_url
requirements	No requirements were recorded.
Travis-CI	No Travis.
coveralls test coverage	No coveralls.

            # 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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