GitHub - teaguesterling/django-chem: A cheminformatics customization of the Django database abstraction layer. See the README file for additional information about the current status of the project.

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A cheminformatics customization of the Django database abstraction layer. See the README file for additional information about the current status of the project.

django-chem.readthedocs.org/

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Name		Name	Last commit message	Last commit date
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django_chem		django_chem
docs		docs
.gitignore		.gitignore
LICENSE		LICENSE
README		README
setup.py		setup.py

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The project consists in a customization/extension of the Django ORM which is intended to support the development of cheminformatics applications.

The existing code is a quick adaptation of some classes from the Django GIS extension and mainly represents a proof-of-concept. Supported backends are currently PostgreSQL (via RDKit's cartridge) and - to a lesser extent - SQLite (via ChemicaLite). Only a limited range of the desired functionality is currently implemented. The available API supports the storage of a molecular structures and structural searches (exact and substructure). 

Draft documentation is available from the 'docs' subdirectory or online
at http://django-chem.readthedocs.org/

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A cheminformatics customization of the Django database abstraction layer. See the README file for additional information about the current status of the project.

django-chem.readthedocs.org/

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