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# Project
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# aiida-dynamic-workflows
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An AiiDA plugin for dynamically composing workflows from Python functions that run as CalcJobs.
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> This repo has been populated by an initial template to help get you started. Please
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> make sure to update the content to build a great experience for community-building.
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**This is experimental, pre-alpha software**.
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As the maintainer of this project, please make a few updates:
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- Improving this README.MD file to provide a great experience
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- Updating SUPPORT.MD with content about this project's support experience
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- Understanding the security reporting process in SECURITY.MD
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- Remove this section from the README
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## Prerequisites
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An environment where the _development_ version of AiiDA is installed.
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This plugin makes use of a bugfix on the development branch, which will
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not be included in an AiiDA release until v2.0.
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## Installing
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As pre-alpha software, this package is **not** released on PyPI.
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Currently the only way to install the plugin is to clone the
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repository and use `pip`:
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```bash
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pip install -e .
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```
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## Initialization
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This plugin uses Conda for managing Python environments on remote computers.
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Any Computers that you use with this plugin must have a `conda_dir` property
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that contains an absolute path to the Conda directory on the machine
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(typically something like `/home/{username}/miniconda3`.
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The `add_extras.py` script in `example_cluster_setup/` can help you with this
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## Examples
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The [`examples/`](./examples) directory contains Jupyter notebooks that illustrate the main
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features of `aiida-dynamic-workflows`. The notebooks are in Markdown format, and so require
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the Jupyter plugin [jupytext](https://jupytext.readthedocs.io/en/latest/) in order to run them.
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## Contributing
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@ -26,8 +49,8 @@ contact [opencode@microsoft.com](mailto:opencode@microsoft.com) with any additio
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## Trademarks
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This project may contain trademarks or logos for projects, products, or services. Authorized use of Microsoft
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trademarks or logos is subject to and must follow
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This project may contain trademarks or logos for projects, products, or services. Authorized use of Microsoft
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trademarks or logos is subject to and must follow
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[Microsoft's Trademark & Brand Guidelines](https://www.microsoft.com/en-us/legal/intellectualproperty/trademarks/usage/general).
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Use of Microsoft trademarks or logos in modified versions of this project must not cause confusion or imply Microsoft sponsorship.
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Any use of third-party trademarks or logos are subject to those third-party's policies.
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