Find hydrated waters in atomic-resolution crystal structures
Project description
Features
Zeigen implements a query of the PDB, with download of metadata. The query is highly configurable through the zeigen.conf configuration file that is placed in a system-dependent config directory upon first program run. The query results are placed in a TSV file, with global stats to a JSON file.
Requirements
Tested on Python 3.9 and 3.10 on Linux and Mac
Installation
You can install Zeigen via pip from PyPI:
$ pip install zeigenUsage
Please see the Command-line Reference for details.
Contributing
Contributions are very welcome. To learn more, see the Contributor Guide.
License
Distributed under the terms of the BSD 3-Clause license, Zeigen is free and open source software.
Issues
If you encounter any problems, please file an issue along with a detailed description.
Credits
Zeigen was written by Joel Berendzen.
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