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jvsguerra committed Oct 28, 2024
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Expand Up @@ -14,6 +14,7 @@ See also:

- [GitHub repository](https://github.com/LBC-LNBio/pyKVFinder/)
- [Documentation and tutorial](https://lbc-lnbio.github.io/pyKVFinder/)
- [ChimeraX plugin](https://lbc-lnbio.github.io/pyKVFinder/plugins/chimerax/index.html)
- [PyMOL plugin](https://lbc-lnbio.github.io/pyKVFinder/plugins/pymol/index.html)

## Installation
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If you use *pyKVFinder* package, please cite:

Guerra, J. V. S., Ribeiro-Filho, H. V., Jara, G. E., Bortot, L. O.,
Pereira, J. G. C., & Lopes-de-Oliveira, P. S. (2021). pyKVFinder: an
efficient and integrable Python package for biomolecular cavity
detection and characterization in data science. BMC bioinformatics,
22(1), 607. <https://doi.org/10.1186/s12859-021-04519-4>.
Guerra, J. V. S., Ribeiro-Filho, H. V., Jara, G. E., Bortot, L. O., Pereira, J. G. C., & Lopes-de-Oliveira, P. S. (2021). pyKVFinder: an efficient and integrable Python package for biomolecular cavity detection and characterization in data science. BMC bioinformatics, 22(1), 607. <https://doi.org/10.1186/s12859-021-04519-4>.

If you use *pyKVFinder.Molecule*, please also cite:

Guerra, J. V. S., Alves, L. F. G., Bourissou, D., Lopes-de-Oliveira, P.
S., & Szalóki, G. (2023). Cavity Characterization in Supramolecular
Cages. Journal of chemical information and modeling, 63(12), 3772-3785.
<https://doi.org/10.1021/acs.jcim.3c00328>.
Guerra, J. V. S., Alves, L. F. G., Bourissou, D., Lopes-de-Oliveira, P. S., & Szalóki, G. (2023). Cavity Characterization in Supramolecular Cages. Journal of chemical information and modeling, 63(12), 3772-3785. <https://doi.org/10.1021/acs.jcim.3c00328>.

If you use *PyMOL pyKVFinder Tools*, please also cite:

Guerra, J. V. da S., Ribeiro Filho, H. V., Bortot, L. O., Honorato, R. V., Pereira, J. G. de C., & Lopes-de-Oliveira, P. S. (2020). ParKVFinder: A thread-level parallel approach in biomolecular cavity detection. In SoftwareX (Vol. 12, p. 100606). Elsevier BV. https://doi.org/10.1016/j.softx.2020.100606.
Guerra, J. V. da S., Ribeiro Filho, H. V., Bortot, L. O., Honorato, R. V., Pereira, J. G. de C., & Lopes-de-Oliveira, P. S. (2020). ParKVFinder: A thread-level parallel approach in biomolecular cavity detection. In SoftwareX (Vol. 12, p. 100606). Elsevier BV. <https://doi.org/10.1016/j.softx.2020.100606>.

## License

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