MADAS - the MAterials DAta Similarity framework
MADAS is a Python framework for calculating fingerprints and similarities from materials science data.
Documentation
The documentation can be found here:
MADAS documentation at readthedocs
Install
MADAS can be installed via pip:
pip install madas
For installation from source, please execute:
git clone --recurse-submodules https://github.com/kubanmar/madas.git
cd madas
pip install .
How to cite
If you use MADAS, please cite our paper:
Martin Kuban, Santiago Rigamonti, and Claudia Draxl:
MADAS: a Python framework for assessing similarity in materials-science data
Digital Discovery 3, (2024), 2448-2457
1 maintainer
Metadata
1 maintainer
Release files for madas 1.3.0
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Source distribution (sdist)
| File | Size | Uploaded | Provenance | Actions |
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Built distribution (wheel)
| File | Interpreter | ABI | Platform | Actions Reset |
|---|---|---|---|---|
| madas-1.3.0-py3-none-any.whl | Python 3 | none | any | Details for madas-1.3.0-py3-none-any.whl |
Total release size: 165.3 kB
Release files / madas-1.3.0.tar.gz
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| Size | 84.5 kB |
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Release files / madas-1.3.0-py3-none-any.whl
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| Size | 80.9 kB |
| Tags | Python 3 |
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