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packmol_step

Project description

packmol step

GitHub pull requests Build Status Code Coverage Code Quality Documentation Status Updates for Dependencies PyPi VERSION

A step for a SEAMM flowchart for building periodic fluid boxes using Packmol

Features

  • TODO

Credits

This package was created with Cookiecutter and the molssi-seamm/cookiecutter-seamm-plugin project template.

Developed by the Molecular Sciences Software Institute (MolSSI), which receives funding from the National Science Foundation under award ACI-1547580

History

0.1.0 (2018-01-05)

  • First release on PyPI.

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