cheminfo / cheminfo/chromatography
Change of format
@lpatiny is already working on this.
Since May 5, 2020.
- Dominant language
- TypeScript
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- 11
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Description
Today for series 2D we have
[
[
[
127.5, 83.7, 75.9, 63.9,
55.9, 43.9, 39.9, 38,
36.8, 36, 34.8, 31.9,
29, 28, 18, 17,
15.9, 13.9
],
[
58, 33, 227, 31, 38,
948, 73, 451, 42, 1017,
258, 905, 42, 1908, 5593,
1444, 147, 60
]
],
An array (the time) of array (2 values, mass, intensity) of array (the mass values and the intensity values).
I would like to change this to
[
{
x : [
127.5, 83.7, 75.9, 63.9,
55.9, 43.9, 39.9, 38,
36.8, 36, 34.8, 31.9,
29, 28, 18, 17,
15.9, 13.9
],
y : [
58, 33, 227, 31, 38,
948, 73, 451, 42, 1017,
258, 905, 42, 1908, 5593,
1444, 147, 60
],
},
This will allow me to add a third parameter (third dimension) that is in this case the msms. We have indeed mass spectra of GC / MS / MS
This would be of course a major release and will also require major release of jcampconverter and mzdata.
@targos Is this ok for you ?
@josoriom This should solve your problem as well.
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