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jmborr / idpflex

Analysis of intrinsically disordered proteins by comparing MD simulations to Small Angle Scattering experiments
http://idpflex.readthedocs.io/en/latest/
MIT License
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Interpolate profiles to experimental qvalues/xvalues #99

Open ConnorPigg opened 5 years ago

ConnorPigg commented 5 years ago

Add keyword arguments to the loading methods to interpolate profiles to match experiments. Also, add a method to ProfileProperty to make this calculation if a profile has already been loaded. Use default interpolation with interp1d but consider allowing choice for interpolation method/kind.