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rickhelmus
/
patRoon
Workflow solutions for mass-spectrometry based non-target analysis.
https://rickhelmus.github.io/patRoon/
GNU General Public License v3.0
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Add visual clue to checkFeatures()
#117
LeonSaal
opened
1 hour ago
0
Add qAlgorithms find features
#116
ricardo-cunha
opened
1 month ago
4
MGF
#115
Boris-Droz
opened
2 months ago
3
MetFrag Score Calculation - How are they calculated in patRoon?
#114
Theodoralee27
opened
2 months ago
6
Advice for validating non-target analysis with known compounds
#113
akogler
opened
4 months ago
1
findFeatures Error - Error in if (!recentFFM) settings <- c(settings, `-algorithm:epd:masstrace_snr_filtering` = boolToChr(traceSNRFiltering)) : missing value where TRUE/FALSE needed
#112
Theodoralee03
closed
5 months ago
4
Report generation occasionally fails
#111
MK3491
opened
5 months ago
10
Error: report with compoundsConsensus fails
#110
LeonSaal
closed
5 months ago
1
Swath acquisition
#109
Boris-Droz
opened
7 months ago
14
merge generateCompounds from different tools
#108
Boris-Droz
closed
7 months ago
6
Error: plotVenn() with featureGroupsComparison
#107
LeonSaal
closed
7 months ago
8
error with generateCompounds( ) - could not run MetFrag
#106
Theodoralee03
closed
8 months ago
4
Using data processing code with already annotated csv file
#105
VR-13
closed
8 months ago
1
Error: Finding features using XCMS
#104
LeonSaal
closed
8 months ago
4
Add conc column to newProject()
#103
LeonSaal
closed
9 months ago
1
Suggestion: 'conc'-column in newProject()
#102
LeonSaal
closed
9 months ago
2
Handbook: Inconsistency for labelled Isotopes
#101
LeonSaal
closed
9 months ago
1
Error: newProject()/Tp Screening unable to add parent suspect list
#100
PiaSchuenemann
closed
9 months ago
5
Added get and plot methods for TICs and BPCs
#99
ricardo-cunha
closed
9 months ago
3
Request: Reduce cache size
#98
LeonSaal
opened
10 months ago
2
Error: graphics device error in Docker
#97
LeonSaal
closed
9 months ago
4
Selection of several adducts
#96
Boris-Droz
closed
9 months ago
3
Filtering MS/MS Peaks with Characteristic Fragment Ions
#95
Jasmin-Zeng
opened
11 months ago
10
Load a previous group features list
#94
Boris-Droz
closed
11 months ago
2
Error: Docker RStudio-server, unable to connect to service
#93
LeonSaal
closed
11 months ago
2
MS2Quant: "Error in if (fingerprints != "") { : the condition has length > 1"
#92
drewszabo
closed
1 year ago
2
MetFrag not functionning with java versions problem being compiled by a more recent version of the Java Runtime (52.0 and 55.0)
#91
EmmEys
closed
1 year ago
1
Does compare/consensus on feature groups only work for fGroups based on the exact same data files (anaInfo)?
#90
bhc928
closed
11 months ago
6
Possibility for feature group filtering based on replicate groups and detection frequencies?
#89
bhc928
closed
1 year ago
2
loadMSLibrary "Error: stod"
#88
drewszabo
closed
1 year ago
2
generateFormulas "Object 'PLID' not found" with SIRIUS and GenForm
#87
drewszabo
closed
1 year ago
5
install error
#86
mingw86
closed
1 year ago
3
Formula generation with multiple adducts and with sirius decomp
#85
joules-pro
opened
1 year ago
1
Request: 'in memory'-option
#84
LeonSaal
opened
1 year ago
3
Error in (function (classes, fdef, mtable)
#83
TantawiOmar
closed
1 year ago
2
Update link to OpenBabel
#82
tsufz
closed
1 year ago
1
MetaClean package deprecated
#81
tsufz
closed
11 months ago
3
Parse spectra and chromatograms from mzml mzxml via cpp
#80
ricardo-cunha
closed
1 year ago
1
Export makeHash, loadCacheData and saveCacheData
#79
ricardo-cunha
closed
1 year ago
0
Updated .gitignore
#78
ricardo-cunha
closed
1 year ago
1
Added patRoon dll and so in src, .Rproj and folder /dev to .gitignore
#77
ricardo-cunha
closed
1 year ago
0
Installation failure
#76
Emma-Palm
closed
1 year ago
2
Docker: request canceled while waiting for connection
#75
tellyshia
closed
1 year ago
2
Export makeHash, loadCacheData and saveCacheData
#74
ricardo-cunha
closed
1 year ago
0
Added patRoon dll and so in src, .Rproj and folder /dev to .gitignore
#73
ricardo-cunha
closed
1 year ago
1
Errors in DA formula calculation and during loading MSP libraries
#72
MK3491
closed
1 year ago
4
Componentization
#71
CorinaMeyer
closed
1 year ago
6
Updated Docker image
#70
akogler
closed
1 year ago
6
Error: newProject(): Loading suspect list for one ionization
#69
LeonSaal
closed
1 year ago
1
Error: selectIons() - could not find chromPeaks
#68
LeonSaal
closed
1 year ago
1
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