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mittinatten / freesasa

C-library for calculating Solvent Accessible Surface Areas
http://freesasa.github.io/
MIT License
110 stars 36 forks source link

Set residue reference SASA through configuration file #31

Open mittinatten opened 7 years ago

mittinatten commented 7 years ago

One should be able to define the reference values for relative accessibilities in a configuration file. Should possibly allow alternative backbone definitions too (but this would require some refactoring). (Related to #27)

mittinatten commented 3 years ago

This requires thinking out a format, writing a new parser and passing it to the classifier. Should not be very difficult, but some work. Looking for volunteers. 🙂