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1 # MS to Peakforest
2
3
4 Metadata
5 --------
6
7 * **@name**: MS2PF
8 * **@version**: 1.1.0
9 * **@authors**: Lain Pavot (PFEM - INRAE - MetaboHUB)
10 * **@maintainers**: Lain Pavot (PFEM - INRAE - MetaboHUB)
11 * **@init date**: 2022, November
12 * **@main usage**:
13 Generates peakforest forms, auto-filled with data and metadata provided
14 with files or parametres.
15 Lets you check data and metadata, correct, and send them to the peakforest
16 instance of you choice.
17
18 test
19 ----
20
21 Test with FragNot data
22 ```sh
23 input='Galaxy10-[Cmpd1-1__INCHIKEY___GIAZPLMMQOERPN-UHFFFAOYSA-N__RT___0..ABINITIOFRAGNOT_PForest.tabular].tabular'
24 input="test-data/${input}"
25 ./server.py \
26 --input ''${input}'',''${input}'',''${input}'' \
27 --raw-metadata \'${input},${input},${input}\' \
28 --method cf_pfem_urine_qtof \
29 --peakforest-url https://metabohub.peakforest.org \
30 --scan-type ms \
31 --polarity positive \
32 --name 'test1,test2,test3'
33 ```
34
35 Test with MS2Snoop data
36 ```sh
37 input='out-smol-base.tsv'
38 input="test-data/${input}"
39 ./server.py \
40 --input ''${input}'' \
41 --method cf_pfem_urine_qtof \
42 --pf_url https://nightly.peakforest.org \
43 --scan_type ms \
44 --polarity positive
45 ```
46
47 Services provided
48 -----------------
49
50 * Help and support: support@workflow4metabolomics.org
51
52
53 License
54 -------
55
56 * Cea Cnrs Inria Logiciel Libre License, version 2.1 (CECILL-2.1)