comparison help.xml @ 0:80df426e7e47 draft

planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/matchms commit 113433b8b9790405c2c5d054aee4a29a21b77dc7
author recetox
date Thu, 30 May 2024 18:07:29 +0000
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1 <macros>
2 <token name="@HELP_matchms@">
3 Documentation
4 The Python library matchms provides functions to convert, filter and compare mass spectrometry data.
5 For an overview of the different galaxy modules, see the figure below.
6 For detailed documentation on the tool, see https://github.com/matchms/matchms/blob/master/README.rst
7 and https://matchms.readthedocs.io/en/latest/ for the Python API.
8
9 Overview
10 .. image:: https://github.com/RECETOX/galaxytools/raw/29e54e69dab6ab1263f56d35ea19f5d7f284d728/tools/matchms/images/matchms_galaxytools.png
11 :width: 3120
12 :height: 1686
13 :scale: 30
14 :alt: Overview of different matchms galaxytools and how they are connected.
15 </token>
16 <token name="@HELP_matchms_networking@">
17 <![CDATA[
18 Documentation
19 For documentation on the tool see https://github.com/matchms/matchms/blob/master/README.rst
20 and https://matchms.readthedocs.io/en/latest/.
21
22 **Upstream Tools**
23
24 matchms similarity
25
26 **Downstream Tools**
27
28 The output is a network-graph file that can be visualized using graph visualization software (e.g., Cytoscape).
29 ]]>
30 </token>
31
32 <token name="@HELP_formatter@">
33 <![CDATA[
34 Usage
35 This tool creates user friendly tables from the similarity scores produced by **matchms similarity**.
36 The tool can be operated on two modes based on (i) thresholds or (ii) top k matches.
37
38 Input Table Format
39 The tool expects a JSON file containing serialized matchms Scores object.
40
41 Output Table Format
42 +----------+-----------+---------+--------+
43 | query | reference | matches | scores |
44 +==========+===========+=========+========+
45 | C001 | Glycine | 6 | 0.5 |
46 +----------+-----------+---------+--------+
47 | C002 | Glycine | 3 | 0.34 |
48 +----------+-----------+---------+--------+
49 | ... | ... | ... | ... |
50 +----------+-----------+---------+--------+
51 ]]>
52 </token>
53 </macros>