chemtools 0.9.1

Table of Contents

• Getting Started

  • Installation

  • Documentation

• Contributing

• Contact

• Citing

• Funding

• License

Getting Started

pip install chemtools

Contributing

• Source

• Report a bug

• Request a feature

• Submit a pull request

Contact

Łukasz Mentel

• github: lmmentel

• email: lmmentel <at> gmail.com

Citing

If you use chemtools in a scientific publication, please consider citing the software as

Łukasz Mentel, chemtools – A Python toolbox for computational chemistry, 2014– . Available at: https://bitbucket.org/lukaszmentel/chemtools.

Here’s the reference in the BibLaTeX format

 @software{chemtools2014,
    author = {Mentel, Łukasz},
    title = {{chemtools} -- A Python toolbox for computational chemistry},
    url = {https://github.com/lmmentel/chemtools},
    version = {0.9.1},
    date = {2014--},
}

or the older BibTeX format

@misc{chemtools2014,
   auhor = {Mentel, Łukasz},
   title = {{chemtools} -- A Python toolbox for computational chemistry, ver. 0.9.1},
   howpublished = {\url{https://github.com/lmmentel/chemtools}},
   year  = {2014--},
}

Funding

This project was realized through the support from the National Science Center (Poland) grant number UMO-2012/07/B/ST4/01347.

License

The project is distributed under the MIT License. See LICENSE for more information.