Integrate
The integrate method performs curve fitting analysis using an exponential-gaussian hybrid model, returning the following peak information: time, width, height, area, and calculated fit.
data = obj.integrate(data, 'OptionName', optionvalue)| Name | Value | Description |
|---|---|---|
data
|
structure | Structure containing chromatography data |
| Name | Value | Description |
|---|---|---|
'samples'
|
'all'
|
Select all samples in data
|
| index |
Row index of samples in data
|
|
'ions'
|
'all'
|
Select all ion chromatograms in samples
|
'tic'
|
Select all total ion chromatograms in samples
|
|
| index |
Column index of ion chromatograms in samples
|
|
'center'
|
value |
Set the center of window to search for peaks
|
'width'
|
value |
Set the width of window to search for peaks
|
'results'
|
'reset'
|
Clear existing peak data before saving results |
'append'
|
Append results to existing peak data | |
'replace'
|
Replace last results with most recent peak data |
| Name | Value | Output |
|---|---|---|
'samples''ions''center'
|
1'tic'18.5
|
 |
'samples''ions''center'
|
1'tic'19.5
|
 |
'samples''ions''center''width'
|
1'tic'20.51.0
|
 |