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SAXS_BioEn

Using a simple example, the Jupyter notebook SAXS_BioEn_example.ipynb shows how to refine structural ensembles with BioEn (https://github.com/bio-phys/bioen) and using SAXS data. At the end of the notebook and as an option, we evaluate the h-statistic and (h,$\chi^2$)-statistic provided by the hplusminus software (https://github.com/bio-phys/hplusminus) to validate the goodness-of-refinement.

The Jupyter notebook runs using Python 3 and the current versions of the bioen and hplusminus software.

Try online without installation!

You can try out the example online and without installation using Binder:

https://bio-phys.pages.mpcdf.de/SAXS_BioEn/

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