Mercurial > repos > lecorguille > xcms_fillpeaks
comparison README.rst @ 26:bb9ee352fce0 draft default tip
planemo upload for repository https://github.com/workflow4metabolomics/tools-metabolomics/ commit 2cb157bd9a8701a3d6874e084032cbd050b8953e
author | workflow4metabolomics |
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date | Mon, 11 Sep 2023 09:15:33 +0000 |
parents | 26d77e9ceb49 |
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1 | |
2 Changelog/News | |
3 -------------- | |
4 | |
5 .. _News: https://bioconductor.org/packages/release/bioc/news/xcms/NEWS | |
6 | |
7 **Version 3.12.0+galaxy* - 03/03/2020** | |
8 | |
9 - UPGRADE: upgrade the xcms version from 3.6.1 to 3.12.0 (see XCMS News_) | |
10 | |
11 **Version 3.6.1.0 - 03/09/2019** | |
12 | |
13 - UPGRADE: upgrade the xcms version from 3.4.4 to 3.6.1 (see XCMS News_) | |
14 | |
15 **Version 3.4.4.0 - 08/02/2019** | |
16 | |
17 - UPGRADE: upgrade the xcms version from 3.0.0 to 3.4.4 (see XCMS News_) | |
18 | |
19 - BUGFIX: issue with Inf values in the exported DataMatrix: https://github.com/sneumann/xcms/issues/323#issuecomment-433044378 | |
20 | |
21 **Version 3.0.0.2 - 09/11/2018** | |
22 | |
23 - BUGFIX: issue when the vector at peakidx is too long and is written in a new line during the export of the peaklist | |
24 | |
25 | |
26 **Version 3.0.0.1 - 09/10/2018** | |
27 | |
28 - IMPROVEMENT: the export of the PeakList is now mandatory | |
29 | |
30 | |
31 **Version 3.0.0.0 - 08/03/2018** | |
32 | |
33 - UPGRADE: upgrade the xcms version from 1.46.0 to 3.0.0. So refactoring of a lot of underlying codes and methods. Some parameters may have been renamed. | |
34 | |
35 - UPDATE: since xcms 3.0.0, the selection of a method is no more needed (chrom or MSW). xcms will detect from the data the peak picking method used in findChromPeaks | |
36 | |
37 - UPDATE: since xcms 3.0.0, new parameters are available: expandMz, expandRt and ppm | |
38 | |
39 | |
40 **Version 2.1.1 - 29/11/2017** | |
41 | |
42 - BUGFIX: To avoid issues with accented letter in the parentFile tag of the mzXML files, we changed a hidden mechanim to LC_ALL=C | |
43 | |
44 | |
45 **Version 2.1.0 - 07/02/2017** | |
46 | |
47 - IMPROVEMENT: change the management of the peaklist ids. The main ids remain the same as xcms generated. The export setiings now only add custom names in the variableMetadata tab (namecustom) | |
48 | |
49 - IMPROVEMENT: xcms.fillpeaks can deal with merged individual data | |
50 | |
51 | |
52 **Version 2.0.8 - 22/12/2016** | |
53 | |
54 - IMPROVEMENT: Add an option to export the peak list at this step without having to wait for CAMERA.annotate | |
55 | |
56 | |
57 **Version 2.0.7 - 06/07/2016** | |
58 | |
59 - UPGRADE: upgrate the xcms version from 1.44.0 to 1.46.0 | |
60 | |
61 | |
62 **Version 2.0.6 - 04/04/2016** | |
63 | |
64 - TEST: refactoring to pass planemo test using conda dependencies | |
65 | |
66 | |
67 **Version 2.0.5 - 10/02/2016** | |
68 | |
69 - BUGFIX: better management of errors. Datasets remained green although the process failed | |
70 | |
71 - UPDATE: refactoring of internal management of inputs/outputs | |
72 | |
73 - UPDATE: refactoring to feed the new report tool | |
74 | |
75 | |
76 **Version 2.0.2 - 02/06/2015** | |
77 | |
78 - IMPROVEMENT: new datatype/dataset formats (rdata.xcms.raw, rdata.xcms.group, rdata.xcms.retcor ...) will facilitate the sequence of tools and so avoid incompatibility errors. | |
79 | |
80 - IMPROVEMENT: parameter labels have changed to facilitate their reading. |