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diffpy.batchpdfsuite

Here is a quick tutorial on how to locally install the package.

How to install diffpy.batchpdfsuite locally

Create and activate a new conda environment:

conda create -n diffpy.batchpdfsuite_env python=3.13 pip
conda activate diffpy.batchpdfsuite_env

Install diffpy.apps dependency

git clone https://github.com/diffpy/diffpy.apps
cd diffpy.apps
conda install --file requirements/conda.txt
pip install .

Install diffpy.batchpdfsuite

It's simple. The only command required is the following:

git clone https://github.com/diffpy/diffpy.batchpdfsuite
cd diffpy.batchpdfsuite
conda install --file requirements/conda.txt
pip install .

The above command will automatically install the dependencies listed in requirements/pip.txt.

Verify your package has been installed

Verify the installation:

pip list

Great! The package is now importable in any Python scripts located on your local machine.

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gui for batch refinements of multiple datasets

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