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Re-implement old features
After code-refactoring, the following features are no longer supported in the simulated mass spec. They should be re-implemented at some point:
- Being able to define multiple isolation windows for one MS2 scan, see here. Also some unit tests for this have been commented out, make sure to uncomment them.
- Functional chromatograms only support Gaussian shapes, not gamma or uniform as before, see here.