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Reusable widgets for AiiDAlab applications.

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Project description

Documentation Status

Base widgets for AiiDAlab

Installation

Install the aiidalab_widgets_base python package via:

pip install aiidalab-widgets-base

Install the corresponding aiidalab-widgets-base AiiDAlab application via the app manager as usual.

Optional dependencies

  • The SmilesWidget widget requires the OpenBabel library.

Documentation

The documentation can be found on the following web page.

Usage

Using the widgets usually just involves importing and displaying them. For demos, have a look at the jupyter notebooks (.ipynb extension) in this folder.

License

MIT

Citation

Users of AiiDAlab are kindly asked to cite the following publication in their own work:

A. V. Yakutovich et al., Comp. Mat. Sci. 188, 110165 (2021). DOI:10.1016/j.commatsci.2020.110165

Contact

aiidalab@materialscloud.org

Acknowledgements

This work is supported by the MARVEL National Centre for Competency in Research funded by the Swiss National Science Foundation, as well as by the MaX European Centre of Excellence funded by the Horizon 2020 EINFRA-5 program, Grant No. 676598.

MARVEL MaX

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