RadostW / PyIDPDiffusion

GUI application for computing IDP protein diffusion written in PyQt5

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PyPDPDiffusion

Monte-carlo algorithm with smart averaging of mobility matrix to predict diffusive properties of IDP

Contact

If you want to colaborate on some use of this code try starting here:

https://www.fuw.edu.pl/~rwaszkiewicz

License

This project is licensed under MIT license

How to cite

  • Diffusion coefficients of elastic macromolecules Bogdan Cichocki, Marcin Rubin, Anna Niedzwiecka, and Piotr Szymczak; J. Fluid Mech. (2019).
  • Rotne-Prager-Yamakawa approximation for different-sized particles in application to macromolecular bead models Pawel Zuk, Eligiusz Wajnryb, Krzysztof Mizerski, and Piotr Szymczak; J. Fluid Mech. (2014).

About

GUI application for computing IDP protein diffusion written in PyQt5

License:MIT License


Languages

Language:Python 63.8%Language:C++ 34.0%Language:Batchfile 1.3%Language:Shell 1.0%