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Citation
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--------
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Please use the following citation in any publication using the `selector` library:
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```md
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@article{
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}
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```
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Installation
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------------
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To install `selector` using the conda package management system, install
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[miniconda](https://conda.io/miniconda.html) or [anaconda](https://www.anaconda.com/download)
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first, and then:
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```bash
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# Create and activate qcdevs conda environment (optional, but recommended)
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conda create -n qcdevs python=3.10
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conda activate qcdevs
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# Install the stable release
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# current conda release is not ready yet
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# conda install -c theochem qc-selector
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# install the development version
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pip install git+https://github.com/theochem/Selector.git
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```
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To install `selector` with `pip`, you may want to create a
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[virtual environment](https://docs.python.org/3/tutorial/venv.html), and then:
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```bash
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# Install the stable release.
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pip install qc-selector
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```
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See https://selector.qcdevs.org for full details.
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---
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title: QC-Selector
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emoji: 🐳
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colorFrom: purple
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colorTo: gray
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sdk: docker
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app_port: 8501
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