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CHECK report for msPurity on tokay2

This page was generated on 2019-04-09 12:26:40 -0400 (Tue, 09 Apr 2019).

Package 1039/1703HostnameOS / ArchINSTALLBUILDCHECKBUILD BIN
msPurity 1.9.8
Thomas N. Lawson
Snapshot Date: 2019-04-08 17:01:18 -0400 (Mon, 08 Apr 2019)
URL: https://git.bioconductor.org/packages/msPurity
Branch: master
Last Commit: 166e189
Last Changed Date: 2019-01-17 06:52:30 -0400 (Thu, 17 Jan 2019)
malbec2 Linux (Ubuntu 18.04.2 LTS) / x86_64  OK  OK  OK UNNEEDED, same version exists in internal repository
tokay2 Windows Server 2012 R2 Standard / x64  OK  OK [ TIMEOUT ] OK 
celaya2 OS X 10.11.6 El Capitan / x86_64  OK  OK  OK  OK UNNEEDED, same version exists in internal repository
merida2 OS X 10.11.6 El Capitan / x86_64  OK  OK  OK  OK 

Summary

Package: msPurity
Version: 1.9.8
Command: C:\Users\biocbuild\bbs-3.9-bioc\R\bin\R.exe CMD check --force-multiarch --install=check:msPurity.install-out.txt --library=C:\Users\biocbuild\bbs-3.9-bioc\R\library --no-vignettes --timings msPurity_1.9.8.tar.gz
StartedAt: 2019-04-09 04:26:48 -0400 (Tue, 09 Apr 2019)
EndedAt: 2019-04-09 05:06:50 -0400 (Tue, 09 Apr 2019)
EllapsedTime: 2401.0 seconds
RetCode: None
Status:  TIMEOUT  
CheckDir: msPurity.Rcheck
Warnings: NA

Command output

##############################################################################
##############################################################################
###
### Running command:
###
###   C:\Users\biocbuild\bbs-3.9-bioc\R\bin\R.exe CMD check --force-multiarch --install=check:msPurity.install-out.txt --library=C:\Users\biocbuild\bbs-3.9-bioc\R\library --no-vignettes --timings msPurity_1.9.8.tar.gz
###
##############################################################################
##############################################################################


* using log directory 'C:/Users/biocbuild/bbs-3.9-bioc/meat/msPurity.Rcheck'
* using R Under development (unstable) (2019-03-09 r76216)
* using platform: x86_64-w64-mingw32 (64-bit)
* using session charset: ISO8859-1
* using option '--no-vignettes'
* checking for file 'msPurity/DESCRIPTION' ... OK
* checking extension type ... Package
* this is package 'msPurity' version '1.9.8'
* checking package namespace information ... OK
* checking package dependencies ... OK
* checking if this is a source package ... OK
* checking if there is a namespace ... OK
* checking for hidden files and directories ... NOTE
Found the following hidden files and directories:
  .travis.yml
These were most likely included in error. See section 'Package
structure' in the 'Writing R Extensions' manual.
* checking for portable file names ... OK
* checking whether package 'msPurity' can be installed ... OK
* checking installed package size ... OK
* checking package directory ... OK
* checking 'build' directory ... OK
* checking DESCRIPTION meta-information ... OK
* checking top-level files ... OK
* checking for left-over files ... OK
* checking index information ... OK
* checking package subdirectories ... OK
* checking R files for non-ASCII characters ... OK
* checking R files for syntax errors ... OK
* loading checks for arch 'i386'
** checking whether the package can be loaded ... OK
** checking whether the package can be loaded with stated dependencies ... OK
** checking whether the package can be unloaded cleanly ... OK
** checking whether the namespace can be loaded with stated dependencies ... OK
** checking whether the namespace can be unloaded cleanly ... OK
* loading checks for arch 'x64'
** checking whether the package can be loaded ... OK
** checking whether the package can be loaded with stated dependencies ... OK
** checking whether the package can be unloaded cleanly ... OK
** checking whether the namespace can be loaded with stated dependencies ... OK
** checking whether the namespace can be unloaded cleanly ... OK
* checking dependencies in R code ... NOTE
Package in Depends field not imported from: 'Rcpp'
  These packages need to be imported from (in the NAMESPACE file)
  for when this namespace is loaded but not attached.
package 'methods' is used but not declared
* checking S3 generic/method consistency ... OK
* checking replacement functions ... OK
* checking foreign function calls ... OK
* checking R code for possible problems ... NOTE
CV: no visible global function definition for 'sd'
Getfiles: no visible global function definition for 'fix'
assessPuritySingle: no visible binding for global variable 'parallel'
averageCluster: no visible global function definition for 'sd'
averageCluster: no visible global function definition for 'median'
averageSpectraSingle: no visible binding for global variable 'scanid'
average_spectra: no visible global function definition for 'median'
covar: no visible global function definition for 'sd'
dimsPredictPuritySingle: no visible global function definition for
  'read.csv'
dimsPredictPuritySingleMz: no visible global function definition for
  'png'
dimsPredictPuritySingleMz: no visible binding for global variable
  'mtchi'
dimsPredictPuritySingleMz: no visible binding for global variable
  'alli'
dimsPredictPuritySingleMz: no visible global function definition for
  'points'
dimsPredictPuritySingleMz: no visible binding for global variable
  'mtch'
dimsPredictPuritySingleMz: no visible global function definition for
  'text'
dimsPredictPuritySingleMz: no visible global function definition for
  'dev.off'
dimsPredictPuritySingleMz: no visible global function definition for
  'median'
dimsPredictPuritySingleMz: no visible global function definition for
  'sd'
export_2_sqlite: no visible global function definition for 'read.table'
export_2_sqlite: no visible global function definition for 'read.csv'
flag_remove: no visible global function definition for 'write.csv'
get_topn: no visible binding for global variable 'topn'
groupPeaksEx: no visible binding for global variable 'median'
iwNormGauss: no visible global function definition for 'dnorm'
iwNormGauss: no visible global function definition for 'approxfun'
iwNormQE.5: no visible global function definition for 'approxfun'
iwNormRcosine: no visible global function definition for 'approxfun'
linearPurity: no visible global function definition for 'approxfun'
medGroup: no visible binding for global variable 'median'
median_match_results: no visible global function definition for
  'median'
msfrProcess: no visible global function definition for 'read.csv'
performHc: no visible global function definition for 'dist'
performHc: no visible global function definition for 'as.dist'
plotPurity: no visible global function definition for 'png'
plotPurity: no visible binding for global variable 'idx'
plotPurity: no visible binding for global variable 'purity'
plotPurity: no visible binding for global variable 'variable'
plotPurity: no visible global function definition for 'dev.off'
plotPurity: no visible global function definition for 'write.csv'
pp4file: no visible global function definition for 'png'
pp4file: no visible global function definition for 'plot'
pp4file: no visible global function definition for 'lines'
pp4file: no visible global function definition for 'legend'
pp4file: no visible global function definition for 'abline'
pp4file: no visible global function definition for 'dev.off'
pp4file: no visible global function definition for 'median'
predictPurityLCMSloop: no visible global function definition for
  'median'
predictPurityLCMSloop : <anonymous>: no visible global function
  definition for 'na.omit'
predictPurityLCMSloop : <anonymous>: no visible global function
  definition for 'median'
predictPurityLCMSloop : <anonymous>: no visible global function
  definition for 'sd'
purityA: no visible binding for global variable 'i'
removeIsotopes: no visible global function definition for 'write.csv'
rsd: no visible global function definition for 'sd'
rsde: no visible global function definition for 'sd'
snrFilter: no visible global function definition for 'median'
stde: no visible global function definition for 'sd'
stderror: no visible global function definition for 'sd'
sum_calc_peaklist: no visible binding for global variable 'median'
write_msp_single: no visible global function definition for
  'packageVersion'
xcmsGroupPurity: no visible binding for global variable 'median'
xcmsGroupPurity: no visible global function definition for 'median'
averageSpectra,purityD: no visible binding for global variable 'i'
subtract,purityD: no visible binding for global variable 'i'
validate,purityA: no visible global function definition for 'head'
writeOut,purityD: no visible global function definition for 'write.csv'
Undefined global functions or variables:
  abline alli approxfun as.dist dev.off dist dnorm fix head i idx
  legend lines median mtch mtchi na.omit packageVersion parallel plot
  png points purity read.csv read.table scanid sd text topn variable
  write.csv
Consider adding
  importFrom("grDevices", "dev.off", "png")
  importFrom("graphics", "abline", "legend", "lines", "plot", "points",
             "text")
  importFrom("stats", "approxfun", "as.dist", "dist", "dnorm", "median",
             "na.omit", "sd")
  importFrom("utils", "fix", "head", "packageVersion", "read.csv",
             "read.table", "write.csv")
to your NAMESPACE file.
* checking Rd files ... OK
* checking Rd metadata ... OK
* checking Rd cross-references ... OK
* checking for missing documentation entries ... OK
* checking for code/documentation mismatches ... OK
* checking Rd \usage sections ... OK
* checking Rd contents ... OK
* checking for unstated dependencies in examples ... OK
* checking files in 'vignettes' ... OK
* checking examples ...
** running examples for arch 'i386' ... OK
Examples with CPU or elapsed time > 5s
                                         user system elapsed
spectral_matching                      161.33   2.74  331.78
averageInterFragSpectra-purityA-method  55.70   0.36   56.07
averageAllFragSpectra-purityA-method    53.00   1.19   55.06
averageIntraFragSpectra-purityA-method  51.42   0.47   51.86
create_database                         49.31   0.55   49.84
createMSP-purityA-method                47.74   0.59   48.34
frag4feature-purityA-method             43.04   0.28   43.29
dimsPredictPurity-purityD-method        36.75   1.30   38.05
flag_remove                             24.11   1.04   58.36
purityX                                 15.62   1.39   16.99
assessPuritySingle                      11.09   0.07   12.54
purityA                                 10.18   0.11   10.25
subtract-purityD-method                  7.37   1.06    8.44
groupPeaks-purityD-method                6.52   1.50    8.01
averageSpectra-purityD-method            6.30   1.27    8.63
groupPeaksEx                             5.22   1.36    6.58
filterp-purityD-method                   4.86   1.24    6.09
** running examples for arch 'x64' ... OK
Examples with CPU or elapsed time > 5s
                                         user system elapsed
spectral_matching                      170.82   6.44  184.18
frag4feature-purityA-method             54.18   0.30   54.72
create_database                         49.75   0.44   50.22
createMSP-purityA-method                45.61   0.55   46.19
averageAllFragSpectra-purityA-method    45.12   0.56   45.67
averageIntraFragSpectra-purityA-method  44.57   0.34   44.90
averageInterFragSpectra-purityA-method  42.39   0.25   42.58
dimsPredictPurity-purityD-method        37.22   1.42   38.66
flag_remove                             25.57   0.72   26.27
purityX                                 15.86   0.55   16.37
purityA                                 11.54   0.04   11.58
subtract-purityD-method                  8.56   1.31    9.87
groupPeaksEx                             7.62   1.49   10.78
assessPuritySingle                       8.73   0.08    8.79
groupPeaks-purityD-method                6.82   1.37    8.20
filterp-purityD-method                   5.68   1.23    6.92
averageSpectra-purityD-method            5.67   0.91    6.60
* checking for unstated dependencies in 'tests' ... OK
* checking tests ...
** running tests for arch 'i386' ...
  Running 'testthat.R'
 OK
** running tests for arch 'x64' ...
  Running 'testthat.R'

Installation output

msPurity.Rcheck/00install.out

##############################################################################
##############################################################################
###
### Running command:
###
###   C:\cygwin\bin\curl.exe -O https://malbec2.bioconductor.org/BBS/3.9/bioc/src/contrib/msPurity_1.9.8.tar.gz && rm -rf msPurity.buildbin-libdir && mkdir msPurity.buildbin-libdir && C:\Users\biocbuild\bbs-3.9-bioc\R\bin\R.exe CMD INSTALL --merge-multiarch --build --library=msPurity.buildbin-libdir msPurity_1.9.8.tar.gz && C:\Users\biocbuild\bbs-3.9-bioc\R\bin\R.exe CMD INSTALL msPurity_1.9.8.zip && rm msPurity_1.9.8.tar.gz msPurity_1.9.8.zip
###
##############################################################################
##############################################################################


  % Total    % Received % Xferd  Average Speed   Time    Time     Time  Current
                                 Dload  Upload   Total   Spent    Left  Speed

  0     0    0     0    0     0      0      0 --:--:-- --:--:-- --:--:--     0
100  973k  100  973k    0     0  8288k      0 --:--:-- --:--:-- --:--:-- 8853k

install for i386

* installing *source* package 'msPurity' ...
** R
** inst
** byte-compile and prepare package for lazy loading
in method for 'averageIntraFragSpectra' with signature '"purityA"': no definition for class "purityA"
in method for 'averageInterFragSpectra' with signature '"purityA"': no definition for class "purityA"
in method for 'averageAllFragSpectra' with signature '"purityA"': no definition for class "purityA"
** help
*** installing help indices
  converting help for package 'msPurity'
    finding HTML links ... done
    Getfiles                                html  
    assessPuritySingle                      html  
    averageAllFragSpectra-purityA-method    html  
    averageInterFragSpectra-purityA-method
                                            html  
    averageIntraFragSpectra-purityA-method
                                            html  
    averageSpectra-purityD-method           html  
    averageSpectraSingle                    html  
    createMSP-purityA-method                html  
    create_database                         html  
    dimsPredictPurity-purityD-method        html  
    dimsPredictPuritySingle                 html  
    filterp-purityD-method                  html  
    flag_remove                             html  
    frag4feature-purityA-method             html  
    getP-purityD-method                     html  
    get_additional_mzml_meta                html  
    groupPeaks-purityD-method               html  
    groupPeaksEx                            html  
    initialize-purityD-method               html  
    iwNormGauss                             html  
    iwNormQE.5                              html  
    iwNormRcosine                           html  
    pcalc                                   html  
    purityA                                 html  
    purityD-class                           html  
    purityX                                 html  
    show-purityA-method                     html  
    show-purityD-method                     html  
    show-purityX-method                     html  
    spectral_matching                       html  
    subtract-purityD-method                 html  
    subtractMZ                              html  
    validate-purityA-method                 html  
    writeOut-purityD-method                 html  
** building package indices
** installing vignettes
** testing if installed package can be loaded from temporary location
** testing if installed package can be loaded from final location
** testing if installed package keeps a record of temporary installation path

install for x64

* installing *source* package 'msPurity' ...
** testing if installed package can be loaded
* MD5 sums
packaged installation of 'msPurity' as msPurity_1.9.8.zip
* DONE (msPurity)
* installing to library 'C:/Users/biocbuild/bbs-3.9-bioc/R/library'
package 'msPurity' successfully unpacked and MD5 sums checked

Tests output

msPurity.Rcheck/tests_i386/testthat.Rout


R Under development (unstable) (2019-03-09 r76216) -- "Unsuffered Consequences"
Copyright (C) 2019 The R Foundation for Statistical Computing
Platform: i386-w64-mingw32/i386 (32-bit)

R is free software and comes with ABSOLUTELY NO WARRANTY.
You are welcome to redistribute it under certain conditions.
Type 'license()' or 'licence()' for distribution details.

R is a collaborative project with many contributors.
Type 'contributors()' for more information and
'citation()' on how to cite R or R packages in publications.

Type 'demo()' for some demos, 'help()' for on-line help, or
'help.start()' for an HTML browser interface to help.
Type 'q()' to quit R.

> library(testthat)
> library(msPurity)
Loading required package: Rcpp
> Sys.setenv("R_TESTS" = "")
> test_check("msPurity")
[1] "########################################################"
[1] "## Checking LCMS based class and functions            ##"
[1] "########################################################"
[1] "########################################################"
[1] "## Checking LCMS based class and functions            ##"
[1] "########################################################"
[1] 6
[1] "########################################################"
[1] "## Checking file list function                        ##"
[1] "########################################################"
[1] "=== check for using csv ==="
[1] "=== check for using mzML ==="
[1] "########################################################"
[1] "## Check average spectra (function only)              ##"
[1] "########################################################"
[1] "=== check single core ==="
[1] "=== check simple clustering ==="
[1] "=== check using MsFileReader output (median SNR thres) ==="
snmeth: median[1] "=== check using MsFileReader output (precalc SNR thres) ==="
snmeth: precalc[1] "########################################################"
[1] "## Check mz subtraction (function only)               ##"
[1] "########################################################"
[1] "########################################################"
[1] "## Check predict purity (function only)               ##"
[1] "########################################################"
[1] "=== Check predicted purity for mzML files ==="
[1] "########################################################"
[1] "## Check groupPeaks (function only)               ##"
[1] "########################################################"
[1] "=== check single core ==="
[1] "########################################################"
[1] "## Check mzML Workflow                                ##"
[1] "########################################################"
[1] "averaging spectra"
[1] "filtering spectra"
[1] "subtracting"
[1] "purity prediction"
[1] "########################################################"
[1] "## checking flag and remove (lc-ms)                   ##"
[1] "########################################################"
          class
LCMS_1    blank
LCMS_2    blank
LCMSMS_1 sample
LCMSMS_2 sample
     mzmed    mzmin    mzmax    rtmed    rtmin    rtmax npeaks blank sample
1 144.0287 144.0284 144.0290 47.37034 46.92627 47.81441      2     0      2
2 166.0550 166.0549 166.0551 64.89254 64.60541 65.17967      2     0      2
3 180.9095 180.9089 180.9102 41.02660 40.95480 41.09841      2     0      2
4 188.1108 188.1108 188.1108 60.70048 60.63481 60.76616      2     0      2
5 219.0095 219.0092 219.0097 41.75565 41.68466 41.82664      2     0      2
6 260.9744 260.9731 260.9757 38.72353 38.65304 38.79402      2     0      2
  LCMS_1 LCMS_2 LCMSMS_1 LCMSMS_2 blank_median_I sample_median_I blank_RSD_I
1     NA     NA  2484505  2537180             NA         2510843          NA
2     NA     NA 56932287 55568583             NA        56250435          NA
3     NA     NA 18476700 17988709             NA        18232705          NA
4     NA     NA 14925267 13776153             NA        14350710          NA
5     NA     NA 38065038 37309939             NA        37687488          NA
6     NA     NA 17290367 17220189             NA        17255278          NA
  sample_RSD_I blank_coverage sample_coverage blank_RSD_RT sample_RSD_RT
1    1.4834625              0               1           NA     1.3257418
2    1.7142699              0               1           NA     0.6257405
3    1.8925417              0               1           NA     0.2475310
4    5.6620664              0               1           NA     0.1530134
5    1.4167453              0               1           NA     0.2404352
6    0.2875833              0               1           NA     0.2574441
  rsd_all_RT grpid blank_valid sample_valid all_sample_valid mzmin_full
1  1.3257418     1           0            1                1   143.9969
2  0.6257405     2           0            1                1   166.0530
3  0.2475310     3           0            1                1   180.8942
4  0.1530134     4           0            1                1   188.1105
5  0.2404352     5           0            1                1   218.9426
6  0.2574441     6           0            1                1   260.9275
  mzmax_full rtmin_full rtmax_full
1   144.0323   34.04152   59.86578
2   166.0862   52.21429   77.26732
3   181.0492   28.20627   52.98104
4   188.1110   46.16103   74.29742
5   219.0265   29.08403   53.73766
6   261.0371   25.57753   50.69718
[1] "########################################################"
[1] "## Checking LCMS based class and functions            ##"
[1] "########################################################"
[1] 4
[1] "########################################################"
[1] "## Checking pcalc functions                           ##"
[1] "########################################################"
[1] "########################################################"
[1] "## Spectral matching functions                        ##"
[1] "########################################################"
== testthat results  ===========================================================
OK: 105 SKIPPED: 0 FAILED: 0
Warning message:
call dbDisconnect() when finished working with a connection 
> 
> proc.time()
   user  system elapsed 
 520.43   12.81  625.50 

msPurity.Rcheck/tests_x64/testthat.Rout


R Under development (unstable) (2019-03-09 r76216) -- "Unsuffered Consequences"
Copyright (C) 2019 The R Foundation for Statistical Computing
Platform: x86_64-w64-mingw32/x64 (64-bit)

R is free software and comes with ABSOLUTELY NO WARRANTY.
You are welcome to redistribute it under certain conditions.
Type 'license()' or 'licence()' for distribution details.

R is a collaborative project with many contributors.
Type 'contributors()' for more information and
'citation()' on how to cite R or R packages in publications.

Type 'demo()' for some demos, 'help()' for on-line help, or
'help.start()' for an HTML browser interface to help.
Type 'q()' to quit R.

> library(testthat)
> library(msPurity)
Loading required package: Rcpp
> Sys.setenv("R_TESTS" = "")
> test_check("msPurity")
[1] "########################################################"
[1] "## Checking LCMS based class and functions            ##"
[1] "########################################################"
[1] "########################################################"
[1] "## Checking LCMS based class and functions            ##"
[1] "########################################################"
[1] 6
[1] "########################################################"
[1] "## Checking file list function                        ##"
[1] "########################################################"
[1] "=== check for using csv ==="
[1] "=== check for using mzML ==="
[1] "########################################################"
[1] "## Check average spectra (function only)              ##"
[1] "########################################################"
[1] "=== check single core ==="
[1] "=== check simple clustering ==="
[1] "=== check using MsFileReader output (median SNR thres) ==="
snmeth: median[1] "=== check using MsFileReader output (precalc SNR thres) ==="
snmeth: precalc[1] "########################################################"
[1] "## Check mz subtraction (function only)               ##"
[1] "########################################################"
[1] "########################################################"
[1] "## Check predict purity (function only)               ##"
[1] "########################################################"
[1] "=== Check predicted purity for mzML files ==="
[1] "########################################################"
[1] "## Check groupPeaks (function only)               ##"
[1] "########################################################"
[1] "=== check single core ==="
[1] "########################################################"
[1] "## Check mzML Workflow                                ##"
[1] "########################################################"
[1] "averaging spectra"
[1] "filtering spectra"
[1] "subtracting"
[1] "purity prediction"
[1] "########################################################"
[1] "## checking flag and remove (lc-ms)                   ##"
[1] "########################################################"
          class
LCMS_1    blank
LCMS_2    blank
LCMSMS_1 sample
LCMSMS_2 sample
     mzmed    mzmin    mzmax    rtmed    rtmin    rtmax npeaks blank sample
1 144.0287 144.0284 144.0290 47.37034 46.92627 47.81441      2     0      2
2 166.0550 166.0549 166.0551 64.89254 64.60541 65.17967      2     0      2
3 180.9095 180.9089 180.9102 41.02660 40.95480 41.09841      2     0      2
4 188.1108 188.1108 188.1108 60.70048 60.63481 60.76616      2     0      2
5 219.0095 219.0092 219.0097 41.75565 41.68466 41.82664      2     0      2
6 260.9744 260.9731 260.9757 38.72353 38.65304 38.79402      2     0      2
  LCMS_1 LCMS_2 LCMSMS_1 LCMSMS_2 blank_median_I sample_median_I blank_RSD_I
1     NA     NA  2484505  2537180             NA         2510843          NA
2     NA     NA 56932287 55568583             NA        56250435          NA
3     NA     NA 18476700 17988709             NA        18232705          NA
4     NA     NA 14925267 13776153             NA        14350710          NA
5     NA     NA 38065038 37309939             NA        37687488          NA
6     NA     NA 17290367 17220189             NA        17255278          NA
  sample_RSD_I blank_coverage sample_coverage blank_RSD_RT sample_RSD_RT
1    1.4834625              0               1           NA     1.3257418
2    1.7142699              0               1           NA     0.6257405
3    1.8925417              0               1           NA     0.2475310
4    5.6620664              0               1           NA     0.1530134
5    1.4167453              0               1           NA     0.2404352
6    0.2875833              0               1           NA     0.2574441
  rsd_all_RT grpid blank_valid sample_valid all_sample_valid mzmin_full
1  1.3257418     1           0            1                1   143.9969
2  0.6257405     2           0            1                1   166.0530
3  0.2475310     3           0            1                1   180.8942
4  0.1530134     4           0            1                1   188.1105
5  0.2404352     5           0            1                1   218.9426
6  0.2574441     6           0            1                1   260.9275
  mzmax_full rtmin_full rtmax_full
1   144.0323   34.04152   59.86578
2   166.0862   52.21429   77.26732
3   181.0492   28.20627   52.98104
4   188.1110   46.16103   74.29742
5   219.0265   29.08403   53.73766
6   261.0371   25.57753   50.69718
[1] "########################################################"
[1] "## Checking LCMS based class and functions            ##"
[1] "########################################################"
[1] 4

Example timings

msPurity.Rcheck/examples_i386/msPurity-Ex.timings

nameusersystemelapsed
Getfiles0.020.000.01
assessPuritySingle11.09 0.0712.54
averageAllFragSpectra-purityA-method53.00 1.1955.06
averageInterFragSpectra-purityA-method55.70 0.3656.07
averageIntraFragSpectra-purityA-method51.42 0.4751.86
averageSpectra-purityD-method6.301.278.63
averageSpectraSingle3.540.704.25
createMSP-purityA-method47.74 0.5948.34
create_database49.31 0.5549.84
dimsPredictPurity-purityD-method36.75 1.3038.05
dimsPredictPuritySingle0.060.010.08
filterp-purityD-method4.861.246.09
flag_remove24.11 1.0458.36
frag4feature-purityA-method43.04 0.2843.29
getP-purityD-method0.020.000.02
get_additional_mzml_meta0.010.000.02
groupPeaks-purityD-method6.521.508.01
groupPeaksEx5.221.366.58
initialize-purityD-method000
iwNormGauss0.010.000.01
iwNormQE.5000
iwNormRcosine000
pcalc000
purityA10.18 0.1110.25
purityD-class000
purityX15.62 1.3916.99
spectral_matching161.33 2.74331.78
subtract-purityD-method7.371.068.44
subtractMZ0.020.000.01

msPurity.Rcheck/examples_x64/msPurity-Ex.timings

nameusersystemelapsed
Getfiles000
assessPuritySingle8.730.088.79
averageAllFragSpectra-purityA-method45.12 0.5645.67
averageInterFragSpectra-purityA-method42.39 0.2542.58
averageIntraFragSpectra-purityA-method44.57 0.3444.90
averageSpectra-purityD-method5.670.916.60
averageSpectraSingle2.540.563.11
createMSP-purityA-method45.61 0.5546.19
create_database49.75 0.4450.22
dimsPredictPurity-purityD-method37.22 1.4238.66
dimsPredictPuritySingle0.050.000.04
filterp-purityD-method5.681.236.92
flag_remove25.57 0.7226.27
frag4feature-purityA-method54.18 0.3054.72
getP-purityD-method000
get_additional_mzml_meta0.030.000.03
groupPeaks-purityD-method6.821.378.20
groupPeaksEx 7.62 1.4910.78
initialize-purityD-method000
iwNormGauss000
iwNormQE.5000
iwNormRcosine000
pcalc000
purityA11.54 0.0411.58
purityD-class000
purityX15.86 0.5516.37
spectral_matching170.82 6.44184.18
subtract-purityD-method8.561.319.87
subtractMZ000