MSP Export

Description

This module exports fragmentation spectra of peaks in the peak list into MSP format file. In addition to the spectra, the following peak characteristics are saved into the file:

Name
Name of the peak as displayed in the peak list
DB#
Row number in the peak list
RT (optional)
Retention time of a feature
ANOVA_P_VALUE (optional)
P-value calculated by the module Data analysis -> One-way ANOVA Test
Num Peaks
Number of peaks in the spectrum

Method Parameters

Add retention time
If selected, each MSP record will contain a line 'RT: retention time'
Add ANOVA p-value (if present)
If selected, each MSP record will contain a line 'ANOVA_P_VALUE: p-value' if such p-value is present
Integer m/z
If selected, fractional m/z values will be rounded to the closest integer and a new intensity is calculated based on the merging mode: