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aquapointer

Project description

PyPI version Downloads Repository Wellcome Leap Discord Chat

aquapointer

Package applying quantum algorithms to find locations of water molecules in a protein cavity.

Getting started

You can use this notebook to get started with aquapointer.

Installing aquapointer

From the top level of the repository, where the setup.py file is found, just run

python setup.py install

Contributing

Aquapointer is developed by Unitary Fund, PASQAL, and Qubit Pharmaceuticals. You are welcome to contribute to the project, open an issue or a pull request.

You can join the #aquapointer channel on the Unitary Fund Discord for community support.

Funding

Work on aquapointer is supported by Wellcome Leap as part of the Quantum for Bio Program (Q4Bio).

License

Aquapointer is released under GPL-3.0 license.

Project details


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aquapointer-0.0.2.tar.gz (16.7 kB view hashes)

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aquapointer-0.0.2-py3-none-any.whl (16.7 kB view hashes)

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