piwheels

chebai

ChEBai is a deep learning library designed for the integration of deep learning methods with chemical ontologies, particularly ChEBI.

Installation

In a virtualenv (see these instructions if you need to create one):

pip3 install chebai

Dependencies

• chembl-structure-pipeline
• torch
• jsonargparse
• transformers
• numpy
• pandas
• pysmiles
• lightning
• rdkit

Releases

Version	Released	Bookworm Python 3.11	Trixie Python 3.13	Files
1.4.0	2026-08-28
chebai-1.4.0-py3-none-any.whl (172 KB)
1.3.0	2026-06-10
chebai-1.3.0-py3-none-any.whl (169 KB)
1.2.0	2026-02-16
chebai-1.2.0-py3-none-any.whl (174 KB)
1.1.0	2025-12-17
chebai-1.1.0-py3-none-any.whl (184 KB)
1.0.3	2025-07-18
1.0.2	2025-07-15
1.0.1	2025-07-10
1.0.0	2025-04-24
0.0.2.dev0 pre-release	2025-04-24
chebai-0.0.2.dev0-py3-none-any.whl (188 KB)
0.0.1	2023-03-04
chebai-0.0.1-py3-none-any.whl (94 KB)
0.0.1.dev0 pre-release	2023-03-04
chebai-0.0.1.dev0-py3-none-any.whl (48 KB)
0.0.0	2023-02-16
chebai-0.0.0-py3-none-any.whl (34 KB)

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