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Created with Raphaël 2.2.031Jul16121185128Jun262528May218Apr10534Jan5Dec28Nov272030Oct24231918218Sep141064331Aug292817151430Jul279628Jun272May30Apr22Mar19610Jan30Nov2930Oct97Sep26Jul24Apr9Dec229Nov18117Oct30Sep12May10311Apr28Mar220Feb1815121110985328Jan222120191815118619Dec181716149127Nov22Oct1413520Sep172129Aug24428Jul2423212019171614Jun4218May1716Apr31Mar24181Feb28Jan2721201919Dec18131285425Nov2413111023Oct222113715Sep822Jul720Jun1626May830Apr2927242322117627Mar262411107418Feb1711106527Jan14916Dec425Nov211328Oct242317144223Sep1916131211954229Aug282730Jul2419181512653227Jun1828May722Apr19171311109854326Mar212019151484127Feb26211823Jan141Oct7Sep328AugFix to allow for user-defined peak selectionMerge branch 'master' into s4powerbackported (foward-ported) the rcdk compatiibility fix into s4powerKeep original m/z in recalibrated spectra, achieved through @properties, and correctly propagate it (as well as any other properties) through the annotationMerge pull request #1 from MaliRemorker/develParallel mzRDifferentiate quasisteady versionAdd Todor and msmsRead.parallelAdd Todor to contributorsVersion bump for S4powerMinimal parallelisation of mzR part of msmsRead.parallelImport parallel packageAdd msmsRead.parallelFixed multiplicity filtering to work identical to 2.3.1 version: removing peaks which fall out due to "refiltering", where formulas may get multiplicity 1. See #219Fixed filterMultiplicity and reanalyzeFailpeaks for incomplete compoundss4power upstrea…s4power upstream/s4powerDon't "clean noise" when no spectra are thereRetrieving recalibration from the parent, since it's stored there. Standard vignette builds nowAdd recalibration into updated workspacedo problematicPeaks spectra-wise, then aggregate. Old workspace now successfully loading, but without recalibration modelsFixing loading old workspaces by re-processing aggregation and multiplicity filtering. Currently not yet working: problematic peaks detectionFixed the edited compiled_ok step for multiple spectratreutler-merge …treutler-merge upstream/treutler-mergeMerge branch 'master' into treutler-mergeAdd getCompTox to Mbworkflow #215bump x.y.z versions to odd y after creation of RELEASE_3_9 branchbump x.y.z versions to even y prior to creation of RELEASE_3_9 branchFixing formula generation for current CRAN rcdk 3.4.7.1 and rcdklibs 2.0.0Fixes to Treutler workflow, vignette now builds almost completelybetter way to handle childIdx "transmission", fixed code for rcdk 3.4.9.2description fixedMerge remote-tracking branch 'github/branch_treutler' into treutler-mergeAdded the possibility to add comments with any sub tagbranch_treutler…branch_treutler upstream/branch_treutlerAdded adductsBump versionMerge branch 'master' of git.bioconductor.org:packages/RMassBankBump versionMerge branch 'master' of github.com:MassBank/RMassBankChange default to CC0feature/default…feature/defaultCC0 upstream/feature/defaultCC0Merge pull request #213 from meier-rene/masterMerge pull request #214 from egonw/patch-1Typo :)