Introduction:
This tool takes a peak table file and a
samples-to-group design file as inputs and outputs the averaged intensity of
every compound in every group.
Input files:
1.
Peak table file in Tab-delimited
txt format, with the first column as the compound identifier and the others as
samples.
For example:
|
AlignID |
STDmix_GC_01 |
STDmix_GC_02 |
STDmix_GC_03 |
|
1 |
1486892478 |
561322777 |
3448620272 |
|
Nitrogen
dioxide |
5492977592 |
684434115 |
3265669981 |
|
Ethanol,
2-fluoro- |
2265686433 |
4182838129 |
4365291513 |
|
3-Pentanone,
2,2,4,4-tetramethyl- |
13390154 |
12612932 |
21155307 |
|
Hydrazine |
14588107 |
8510918 |
7224351 |
2.
Sample-to-group design file,
Tab-delimited text file with two columns, "sample " and "group
".
For example:
|
STDmix_GC_01 |
Group1 |
|
STDmix_GC_02 |
Group1 |
|
STDmix_GC_03 |
Group2 |
Output files:
'group_aver_pkTable.txt', average intensity results in each group.
For example:
|
AlignID |
Group1 |
Group2 |
|
1 |
1024107628 |
3448620272 |
|
Nitrogen dioxide |
3088705854 |
3265669981 |
|
Ethanol, 2-fluoro- |
3224262281 |
4365291513 |
|
3-Pentanone, 2,2,4,4-tetramethyl- |
13001543 |
21155307 |
|
Hydrazine |
11549512.5 |
7224351 |