Version 3.12.0+galaxy* - 03/03/2020
- UPGRADE: upgrade the xcms version from 3.6.1 to 3.12.0 (see XCMS News)
Version 3.6.1.0 - 03/09/2019
- UPGRADE: upgrade the xcms version from 3.4.4 to 3.6.1 (see XCMS News)
Version 3.4.4.0 - 08/02/2019
- UPGRADE: upgrade the xcms version from 3.0.0 to 3.4.4 (see XCMS News)
- BUGFIX: issue with Inf values in the exported DataMatrix: sneumann/xcms#323 (comment)
Version 3.0.0.2 - 09/11/2018
- BUGFIX: issue when the vector at peakidx is too long and is written in a new line during the export of the peaklist
Version 3.0.0.1 - 09/10/2018
- IMPROVEMENT: the export of the PeakList is now mandatory
Version 3.0.0.0 - 08/03/2018
- 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.
- 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
- UPDATE: since xcms 3.0.0, new parameters are available: expandMz, expandRt and ppm
Version 2.1.1 - 29/11/2017
- BUGFIX: To avoid issues with accented letter in the parentFile tag of the mzXML files, we changed a hidden mechanim to LC_ALL=C
Version 2.1.0 - 07/02/2017
- 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)
- IMPROVEMENT: xcms.fillpeaks can deal with merged individual data
Version 2.0.8 - 22/12/2016
- IMPROVEMENT: Add an option to export the peak list at this step without having to wait for CAMERA.annotate
Version 2.0.7 - 06/07/2016
- UPGRADE: upgrate the xcms version from 1.44.0 to 1.46.0
Version 2.0.6 - 04/04/2016
- TEST: refactoring to pass planemo test using conda dependencies
Version 2.0.5 - 10/02/2016
- BUGFIX: better management of errors. Datasets remained green although the process failed
- UPDATE: refactoring of internal management of inputs/outputs
- UPDATE: refactoring to feed the new report tool
Version 2.0.2 - 02/06/2015
- 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.
- IMPROVEMENT: parameter labels have changed to facilitate their reading.