cheminfo
Range picking of ethylbenzene is wrong
At the moment we are not able to changes the default parameters of automatic-peak picking in nmrium, it is due probably to a big number of points. We need to think about a dynamic window size for GSD.
@jobo322 Could you test locally by hardcoding some parameters to check if it helps ?
we need be able to modify the some parameter for the ranges detection tool, otherwise it will not works for all situation. e.g the signal of citrate has a j-coupling of aprox 16 Hz. but the next region has several signals that we should not join as a signal. So how we should handle this peaks grouping.
I did increment the percent of intensity with respect to the top that a peak should reach to take it into the account. The new default value is 0.01 (10 %)
Not sure what means this factor. Is it based on the top of a multiplet or the global ratio in the full spectrum.
What is sure is that an heptuplet is not exceptional. A isopropyl for example. The ratio is then 1 6 15 20 15 6 1. Even a isobutyl would give the a nonaplet. So 10% does not seems like a good default value.
Concerning the following molecule the system finds 2 doublets instead of a doublet of doublet as well.
We need to add options for the automatic peak picking.
With ethyl vinyl ether it is quite wrong
