[WIP] Added a gaussian process baseline fitting procedure.

choderalab / bayesian-itc

Python tools for the analysis and modeling of isothermal titration calorimetry (ITC) experiments.

GNU General Public License v3.0

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Closed bas-rustenburg closed 9 years ago

bas-rustenburg commented 9 years ago

I was kinda curious about the baseline stuff, so I gave it a try.

Not done yet but looking promising.

Red is the data used for fit, blue is the remaining data, black dots for the prediction with gray confidence intervals of 95%. baseline

pgrinaway commented 9 years ago

bas-rustenburg commented 9 years ago

Old fitting:

exponential_fit-baseline

New fitting: gaussian-baseline

jchodera commented 9 years ago

Sounds great!