Oriol Senan Campos
| Snapshot Date: 2021-05-05 14:51:38 -0400 (Wed, 05 May 2021) |
| URL: https://git.bioconductor.org/packages/cliqueMS |
| Branch: RELEASE_3_12 |
| Last Commit: 89665c6 |
| Last Changed Date: 2020-10-27 11:51:40 -0400 (Tue, 27 Oct 2020) |
| Back to Multiple platform build/check report for BioC 3.12 |
|
This page was generated on 2021-05-06 12:30:16 -0400 (Thu, 06 May 2021).
|
To the developers/maintainers of the cliqueMS package: Please make sure to use the following settings in order to reproduce any error or warning you see on this page. |
| Package 313/1974 | Hostname | OS / Arch | INSTALL | BUILD | CHECK | BUILD BIN | ||||||||
| cliqueMS 1.4.0 (landing page) Oriol Senan Campos
| malbec1 | Linux (Ubuntu 18.04.5 LTS) / x86_64 | OK | OK | OK | | ||||||||
| tokay1 | Windows Server 2012 R2 Standard / x64 | OK | OK | OK | OK | | ||||||||
| merida1 | macOS 10.14.6 Mojave / x86_64 | OK | OK | OK | OK | | ||||||||
| Package: cliqueMS |
| Version: 1.4.0 |
| Command: C:\Users\biocbuild\bbs-3.12-bioc\R\bin\R.exe CMD check --force-multiarch --install=check:cliqueMS.install-out.txt --library=C:\Users\biocbuild\bbs-3.12-bioc\R\library --no-vignettes --timings cliqueMS_1.4.0.tar.gz |
| StartedAt: 2021-05-06 01:29:49 -0400 (Thu, 06 May 2021) |
| EndedAt: 2021-05-06 01:38:14 -0400 (Thu, 06 May 2021) |
| EllapsedTime: 504.4 seconds |
| RetCode: 0 |
| Status: OK |
| CheckDir: cliqueMS.Rcheck |
| Warnings: 0 |
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### Running command:
###
### C:\Users\biocbuild\bbs-3.12-bioc\R\bin\R.exe CMD check --force-multiarch --install=check:cliqueMS.install-out.txt --library=C:\Users\biocbuild\bbs-3.12-bioc\R\library --no-vignettes --timings cliqueMS_1.4.0.tar.gz
###
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* using log directory 'C:/Users/biocbuild/bbs-3.12-bioc/meat/cliqueMS.Rcheck'
* using R version 4.0.5 (2021-03-31)
* using platform: x86_64-w64-mingw32 (64-bit)
* using session charset: ISO8859-1
* using option '--no-vignettes'
* checking for file 'cliqueMS/DESCRIPTION' ... OK
* checking extension type ... Package
* this is package 'cliqueMS' version '1.4.0'
* package encoding: UTF-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 ... OK
* checking for portable file names ... OK
* checking whether package 'cliqueMS' 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
Namespace in Imports field not imported from: 'MSnbase'
All declared Imports should be used.
* checking S3 generic/method consistency ... OK
* checking replacement functions ... OK
* checking foreign function calls ... OK
* checking R code for possible problems ... OK
* 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 contents of 'data' directory ... OK
* checking data for non-ASCII characters ... OK
* checking data for ASCII and uncompressed saves ... OK
* checking line endings in C/C++/Fortran sources/headers ... OK
* checking line endings in Makefiles ... OK
* checking compilation flags in Makevars ... OK
* checking for GNU extensions in Makefiles ... OK
* checking for portable use of $(BLAS_LIBS) and $(LAPACK_LIBS) ... OK
* checking use of PKG_*FLAGS in Makefiles ... OK
* checking compiled code ... NOTE
Note: information on .o files for i386 is not available
Note: information on .o files for x64 is not available
File 'C:/Users/biocbuild/bbs-3.12-bioc/R/library/cliqueMS/libs/i386/cliqueMS.dll':
Found 'abort', possibly from 'abort' (C), 'runtime' (Fortran)
Found 'exit', possibly from 'exit' (C), 'stop' (Fortran)
Found 'printf', possibly from 'printf' (C)
File 'C:/Users/biocbuild/bbs-3.12-bioc/R/library/cliqueMS/libs/x64/cliqueMS.dll':
Found 'abort', possibly from 'abort' (C), 'runtime' (Fortran)
Found 'exit', possibly from 'exit' (C), 'stop' (Fortran)
Found 'printf', possibly from 'printf' (C)
Compiled code should not call entry points which might terminate R nor
write to stdout/stderr instead of to the console, nor use Fortran I/O
nor system RNGs. The detected symbols are linked into the code but
might come from libraries and not actually be called.
See 'Writing portable packages' in the 'Writing R Extensions' manual.
* checking files in 'vignettes' ... OK
* checking examples ...
** running examples for arch 'i386' ... OK
Examples with CPU (user + system) or elapsed time > 5s
user system elapsed
createNetwork 9.28 0.18 9.45
createanClique 6.25 0.07 6.33
anClique-class 5.27 0.30 6.40
computeCliques 5.17 0.10 5.28
** running examples for arch 'x64' ... OK
Examples with CPU (user + system) or elapsed time > 5s
user system elapsed
createNetwork 8.72 0.04 8.75
createanClique 6.58 0.04 6.62
anClique-class 5.05 0.06 5.11
computeCliques 4.98 0.07 5.06
* 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'
OK
* checking for unstated dependencies in vignettes ... OK
* checking package vignettes in 'inst/doc' ... OK
* checking running R code from vignettes ... SKIPPED
* checking re-building of vignette outputs ... SKIPPED
* checking PDF version of manual ... OK
* DONE
Status: 2 NOTEs
See
'C:/Users/biocbuild/bbs-3.12-bioc/meat/cliqueMS.Rcheck/00check.log'
for details.
cliqueMS.Rcheck/00install.out
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###
### Running command:
###
### C:\cygwin\bin\curl.exe -O http://172.29.0.3/BBS/3.12/bioc/src/contrib/cliqueMS_1.4.0.tar.gz && rm -rf cliqueMS.buildbin-libdir && mkdir cliqueMS.buildbin-libdir && C:\Users\biocbuild\bbs-3.12-bioc\R\bin\R.exe CMD INSTALL --merge-multiarch --build --library=cliqueMS.buildbin-libdir cliqueMS_1.4.0.tar.gz && C:\Users\biocbuild\bbs-3.12-bioc\R\bin\R.exe CMD INSTALL cliqueMS_1.4.0.zip && rm cliqueMS_1.4.0.tar.gz cliqueMS_1.4.0.zip
###
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% 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 559k 100 559k 0 0 28.7M 0 --:--:-- --:--:-- --:--:-- 30.3M
install for i386
* installing *source* package 'cliqueMS' ...
** using staged installation
** libs
"C:/rtools40/mingw32/bin/"g++ -std=gnu++11 -I"C:/Users/BIOCBU~1/BBS-3~1.12-/R/include" -DNDEBUG -I'C:/Users/biocbuild/bbs-3.12-bioc/R/library/Rcpp/include' -I'C:/Users/biocbuild/bbs-3.12-bioc/R/library/BH/include' -I'C:/Users/biocbuild/bbs-3.12-bioc/R/library/RcppArmadillo/include' -I"C:/extsoft/include" -fopenmp -O2 -Wall -mfpmath=sse -msse2 -mstackrealign -c RcppExports.cpp -o RcppExports.o
"C:/rtools40/mingw32/bin/"g++ -std=gnu++11 -I"C:/Users/BIOCBU~1/BBS-3~1.12-/R/include" -DNDEBUG -I'C:/Users/biocbuild/bbs-3.12-bioc/R/library/Rcpp/include' -I'C:/Users/biocbuild/bbs-3.12-bioc/R/library/BH/include' -I'C:/Users/biocbuild/bbs-3.12-bioc/R/library/RcppArmadillo/include' -I"C:/extsoft/include" -fopenmp -O2 -Wall -mfpmath=sse -msse2 -mstackrealign -c findAnnotationR.cpp -o findAnnotationR.o
In file included from findAnnotationR.cpp:1:
annotationCliqueMSR.h: In function 'std::vector<std::pair<double, double> > sortMass(annotData&, int, std::unordered_map<double, std::pair<double, double> >, int)':
annotationCliqueMSR.h:440:11: warning: comparison of integer expressions of different signedness: 'int' and 'std::vector<std::pair<double, double> >::size_type' {aka 'unsigned int'} [-Wsign-compare]
if(id < allM.size()) // not add more masses in case that for that feature are less than "n" top masses
~~~^~~~~~~~~~~~~
annotationCliqueMSR.h: In function 'std::unordered_set<double> getTopScoringMasses(annotData&, int, rawadList, int, int, double)':
annotationCliqueMSR.h:476:11: warning: comparison of integer expressions of different signedness: 'int' and 'std::vector<std::pair<double, double> >::size_type' {aka 'unsigned int'} [-Wsign-compare]
if(id < allM.size()) // not add more masses in case that there are less than "n" top masses
~~~^~~~~~~~~~~~~
annotationCliqueMSR.h: In function 'std::vector<int> sortAnnotations(std::unordered_map<int, Annotation>&, int)':
annotationCliqueMSR.h:725:11: warning: comparison of integer expressions of different signedness: 'int' and 'std::vector<std::pair<double, int> >::size_type' {aka 'unsigned int'} [-Wsign-compare]
if(id < allAn.size() )
~~~^~~~~~~~~~~~~~
annotationCliqueMSR.h: In function 'double computeMaxScore(std::vector<double>&, int, double)':
annotationCliqueMSR.h:739:24: warning: 'completeroundscore' may be used uninitialized in this function [-Wmaybe-uninitialized]
completeroundscore += *ritv;
~~~~~~~~~~~~~~~~~~~^~~~~~~~
"C:/rtools40/mingw32/bin/"g++ -std=gnu++11 -I"C:/Users/BIOCBU~1/BBS-3~1.12-/R/include" -DNDEBUG -I'C:/Users/biocbuild/bbs-3.12-bioc/R/library/Rcpp/include' -I'C:/Users/biocbuild/bbs-3.12-bioc/R/library/BH/include' -I'C:/Users/biocbuild/bbs-3.12-bioc/R/library/RcppArmadillo/include' -I"C:/extsoft/include" -fopenmp -O2 -Wall -mfpmath=sse -msse2 -mstackrealign -c findCliquesR.cpp -o findCliquesR.o
In file included from findCliquesR.cpp:2:
networkCliqueMSR.h: In function 'Edges createEdges(Rcpp::DataFrame)':
networkCliqueMSR.h:38:37: warning: comparison of integer expressions of different signedness: 'unsigned int' and 'R_xlen_t' {aka 'int'} [-Wsign-compare]
for(unsigned int index = 0; index < vnode1.size(); index++) {
~~~~~~^~~~~~~~~~~~~~~
"C:/rtools40/mingw32/bin/"g++ -std=gnu++11 -I"C:/Users/BIOCBU~1/BBS-3~1.12-/R/include" -DNDEBUG -I'C:/Users/biocbuild/bbs-3.12-bioc/R/library/Rcpp/include' -I'C:/Users/biocbuild/bbs-3.12-bioc/R/library/BH/include' -I'C:/Users/biocbuild/bbs-3.12-bioc/R/library/RcppArmadillo/include' -I"C:/extsoft/include" -fopenmp -O2 -Wall -mfpmath=sse -msse2 -mstackrealign -c findIsotopesR.cpp -o findIsotopesR.o
C:/rtools40/mingw32/bin/g++ -shared -s -static-libgcc -o cliqueMS.dll tmp.def RcppExports.o findAnnotationR.o findCliquesR.o findIsotopesR.o -fopenmp -LC:/Users/BIOCBU~1/BBS-3~1.12-/R/bin/i386 -lRlapack -LC:/Users/BIOCBU~1/BBS-3~1.12-/R/bin/i386 -lRblas -lgfortran -lm -lquadmath -LC:/extsoft/lib/i386 -LC:/extsoft/lib -LC:/Users/BIOCBU~1/BBS-3~1.12-/R/bin/i386 -lR
installing to C:/Users/biocbuild/bbs-3.12-bioc/meat/cliqueMS.buildbin-libdir/00LOCK-cliqueMS/00new/cliqueMS/libs/i386
** R
** data
** inst
** byte-compile and prepare package for lazy loading
** help
*** installing help indices
converting help for package 'cliqueMS'
finding HTML links ... done
anClique-class html
anClique html
cliqueMS html
computeCliques html
createNetwork html
createanClique html
ex.cliqueGroups html
getAnnotation html
getCliques html
getIsotopes html
negative.adinfo html
positive.adinfo 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 'cliqueMS' ...
** libs
"C:/rtools40/mingw64/bin/"g++ -std=gnu++11 -I"C:/Users/BIOCBU~1/BBS-3~1.12-/R/include" -DNDEBUG -I'C:/Users/biocbuild/bbs-3.12-bioc/R/library/Rcpp/include' -I'C:/Users/biocbuild/bbs-3.12-bioc/R/library/BH/include' -I'C:/Users/biocbuild/bbs-3.12-bioc/R/library/RcppArmadillo/include' -I"C:/extsoft/include" -fopenmp -O2 -Wall -mfpmath=sse -msse2 -mstackrealign -c RcppExports.cpp -o RcppExports.o
"C:/rtools40/mingw64/bin/"g++ -std=gnu++11 -I"C:/Users/BIOCBU~1/BBS-3~1.12-/R/include" -DNDEBUG -I'C:/Users/biocbuild/bbs-3.12-bioc/R/library/Rcpp/include' -I'C:/Users/biocbuild/bbs-3.12-bioc/R/library/BH/include' -I'C:/Users/biocbuild/bbs-3.12-bioc/R/library/RcppArmadillo/include' -I"C:/extsoft/include" -fopenmp -O2 -Wall -mfpmath=sse -msse2 -mstackrealign -c findAnnotationR.cpp -o findAnnotationR.o
In file included from findAnnotationR.cpp:1:
annotationCliqueMSR.h: In function 'std::vector<std::pair<double, double> > sortMass(annotData&, int, std::unordered_map<double, std::pair<double, double> >, int)':
annotationCliqueMSR.h:440:11: warning: comparison of integer expressions of different signedness: 'int' and 'std::vector<std::pair<double, double> >::size_type' {aka 'long long unsigned int'} [-Wsign-compare]
if(id < allM.size()) // not add more masses in case that for that feature are less than "n" top masses
~~~^~~~~~~~~~~~~
annotationCliqueMSR.h: In function 'std::unordered_set<double> getTopScoringMasses(annotData&, int, rawadList, int, int, double)':
annotationCliqueMSR.h:476:11: warning: comparison of integer expressions of different signedness: 'int' and 'std::vector<std::pair<double, double> >::size_type' {aka 'long long unsigned int'} [-Wsign-compare]
if(id < allM.size()) // not add more masses in case that there are less than "n" top masses
~~~^~~~~~~~~~~~~
annotationCliqueMSR.h: In function 'std::vector<int> sortAnnotations(std::unordered_map<int, Annotation>&, int)':
annotationCliqueMSR.h:725:11: warning: comparison of integer expressions of different signedness: 'int' and 'std::vector<std::pair<double, int> >::size_type' {aka 'long long unsigned int'} [-Wsign-compare]
if(id < allAn.size() )
~~~^~~~~~~~~~~~~~
annotationCliqueMSR.h: In function 'double computeMaxScore(std::vector<double>&, int, double)':
annotationCliqueMSR.h:739:24: warning: 'completeroundscore' may be used uninitialized in this function [-Wmaybe-uninitialized]
completeroundscore += *ritv;
~~~~~~~~~~~~~~~~~~~^~~~~~~~
"C:/rtools40/mingw64/bin/"g++ -std=gnu++11 -I"C:/Users/BIOCBU~1/BBS-3~1.12-/R/include" -DNDEBUG -I'C:/Users/biocbuild/bbs-3.12-bioc/R/library/Rcpp/include' -I'C:/Users/biocbuild/bbs-3.12-bioc/R/library/BH/include' -I'C:/Users/biocbuild/bbs-3.12-bioc/R/library/RcppArmadillo/include' -I"C:/extsoft/include" -fopenmp -O2 -Wall -mfpmath=sse -msse2 -mstackrealign -c findCliquesR.cpp -o findCliquesR.o
"C:/rtools40/mingw64/bin/"g++ -std=gnu++11 -I"C:/Users/BIOCBU~1/BBS-3~1.12-/R/include" -DNDEBUG -I'C:/Users/biocbuild/bbs-3.12-bioc/R/library/Rcpp/include' -I'C:/Users/biocbuild/bbs-3.12-bioc/R/library/BH/include' -I'C:/Users/biocbuild/bbs-3.12-bioc/R/library/RcppArmadillo/include' -I"C:/extsoft/include" -fopenmp -O2 -Wall -mfpmath=sse -msse2 -mstackrealign -c findIsotopesR.cpp -o findIsotopesR.o
C:/rtools40/mingw64/bin/g++ -shared -s -static-libgcc -o cliqueMS.dll tmp.def RcppExports.o findAnnotationR.o findCliquesR.o findIsotopesR.o -fopenmp -LC:/Users/BIOCBU~1/BBS-3~1.12-/R/bin/x64 -lRlapack -LC:/Users/BIOCBU~1/BBS-3~1.12-/R/bin/x64 -lRblas -lgfortran -lm -lquadmath -LC:/extsoft/lib/x64 -LC:/extsoft/lib -LC:/Users/BIOCBU~1/BBS-3~1.12-/R/bin/x64 -lR
installing to C:/Users/biocbuild/bbs-3.12-bioc/meat/cliqueMS.buildbin-libdir/cliqueMS/libs/x64
** testing if installed package can be loaded
* MD5 sums
packaged installation of 'cliqueMS' as cliqueMS_1.4.0.zip
* DONE (cliqueMS)
* installing to library 'C:/Users/biocbuild/bbs-3.12-bioc/R/library'
package 'cliqueMS' successfully unpacked and MD5 sums checked
|
cliqueMS.Rcheck/tests_i386/testthat.Rout
R version 4.0.5 (2021-03-31) -- "Shake and Throw"
Copyright (C) 2021 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(cliqueMS)
>
> test_check("cliqueMS")
adduct log10freq massdiff nummol charge
1 [M+2H-NH3]2+ -3.5129044 -15.012016600 1 2
2 [Cat]3+ -3.5129044 -0.001645737 1 3
3 [Cat]2+ -3.5129044 -0.001040400 1 2
4 [Cat+H]2+ -3.3368132 1.006178842 1 2
5 [M+2H]2+ -1.8139344 2.014552000 1 2
6 [M+H+Na]2+ -2.6999911 23.996494000 1 2
7 [M+2H+Na]3+ -3.8139344 25.003770000 1 3
8 [M+H+K]2+ -2.2341508 39.970434000 1 2
9 [M+2Na]2+ -2.6678064 45.978436000 1 2
10 [M+H+2Na]3+ -3.5129044 46.985730000 1 3
11 [M+3Na]3+ -3.5129044 68.967654000 1 3
12 [M+H]+ -0.2689987 1.007276000 1 1
13 [M+H-H2O]+ -0.7476085 -17.003277800 1 1
14 [M+Na]+ -0.9632882 22.989218000 1 1
15 [M+H-NH3]+ -1.5886251 -16.019274320 1 1
16 [M-H+2Na]+ -1.8596919 44.971164440 1 1
17 [Cat]+ -1.8948563 -0.000548579 1 1
18 [M-2H+3Na]+ -1.9108444 66.953081400 1 1
19 [M+H+H2O]+ -2.3225727 19.017868210 1 1
20 [M+K]+ -2.4159944 38.963158000 1 1
21 [M+NH4]+ -2.4917151 18.033823000 1 1
22 [M-H+2K]+ -3.1149644 76.919040000 1 1
23 [Cat+H2O]+ -3.2118744 18.010011000 1 1
24 [M+H-OH]+ -3.2118744 -15.995481930 1 1
25 [Cat-H2O]+ -3.5129044 -18.011087900 1 1
26 [Cat-H]+ -3.5129044 -1.008340400 1 1
27 [M+Na-H2O]+ -3.5129044 4.978142219 1 1
28 [M-2H+3K]+ -3.5129044 114.874881400 1 1
29 [M+K-H2O]+ -3.8139344 20.952042220 1 1
30 [M-CO2H+H]+ -4.8139344 -43.989863780 1 1
31 [3M+H-H2O]+ -4.8139344 -17.003277800 3 1
32 [2M+H]+ -1.2239848 1.007276000 2 1
33 [3M+H]+ -2.2698664 1.007276000 3 1
34 [2M+Na-H2O]+ -3.8139344 4.978142219 2 1
35 [2M+K-H2O]+ -3.8139344 20.952042220 2 1
36 [3M+K-H2O]+ -4.8139344 20.952042220 3 1
37 [2M+Na]+ -2.9688364 22.989218000 2 1
38 [2M+K]+ -3.8139344 38.963142220 2 1
39 [3M+K]+ -3.8139344 38.963142220 3 1
[1] -1.31290442 -1.31290442 -1.31290442 -1.13681316 0.38606558 -0.49999107
[7] -1.61393442 -0.03415082 -0.46780638 -1.31290442 -1.31290442 1.93100135
[13] 1.45239151 1.23671182 0.61137486 0.34030809 0.30514367 0.28915557
[19] -0.12257272 -0.21599441 -0.29171512 -0.91496441 -1.01187443 -1.01187443
[25] -1.31290442 -1.31290442 -1.31290442 -1.31290442 -1.61393442 -2.61393442
[31] -2.61393442 0.97601518 -0.06986637 -1.61393442 -1.61393442 -2.61393442
[37] -0.76883638 -1.61393442 -1.61393442
Beggining value of logl is -722.284
Aggregate cliques done, with 164 rounds
Kernighan-Lin done with 2 rounds
Finishing value of logl is -161.574
[ FAIL 0 | WARN 0 | SKIP 0 | PASS 14 ]
>
> proc.time()
user system elapsed
19.75 1.18 21.00
|
cliqueMS.Rcheck/tests_x64/testthat.Rout
R version 4.0.5 (2021-03-31) -- "Shake and Throw"
Copyright (C) 2021 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(cliqueMS)
>
> test_check("cliqueMS")
adduct log10freq massdiff nummol charge
1 [M+2H-NH3]2+ -3.5129044 -15.012016600 1 2
2 [Cat]3+ -3.5129044 -0.001645737 1 3
3 [Cat]2+ -3.5129044 -0.001040400 1 2
4 [Cat+H]2+ -3.3368132 1.006178842 1 2
5 [M+2H]2+ -1.8139344 2.014552000 1 2
6 [M+H+Na]2+ -2.6999911 23.996494000 1 2
7 [M+2H+Na]3+ -3.8139344 25.003770000 1 3
8 [M+H+K]2+ -2.2341508 39.970434000 1 2
9 [M+2Na]2+ -2.6678064 45.978436000 1 2
10 [M+H+2Na]3+ -3.5129044 46.985730000 1 3
11 [M+3Na]3+ -3.5129044 68.967654000 1 3
12 [M+H]+ -0.2689987 1.007276000 1 1
13 [M+H-H2O]+ -0.7476085 -17.003277800 1 1
14 [M+Na]+ -0.9632882 22.989218000 1 1
15 [M+H-NH3]+ -1.5886251 -16.019274320 1 1
16 [M-H+2Na]+ -1.8596919 44.971164440 1 1
17 [Cat]+ -1.8948563 -0.000548579 1 1
18 [M-2H+3Na]+ -1.9108444 66.953081400 1 1
19 [M+H+H2O]+ -2.3225727 19.017868210 1 1
20 [M+K]+ -2.4159944 38.963158000 1 1
21 [M+NH4]+ -2.4917151 18.033823000 1 1
22 [M-H+2K]+ -3.1149644 76.919040000 1 1
23 [Cat+H2O]+ -3.2118744 18.010011000 1 1
24 [M+H-OH]+ -3.2118744 -15.995481930 1 1
25 [Cat-H2O]+ -3.5129044 -18.011087900 1 1
26 [Cat-H]+ -3.5129044 -1.008340400 1 1
27 [M+Na-H2O]+ -3.5129044 4.978142219 1 1
28 [M-2H+3K]+ -3.5129044 114.874881400 1 1
29 [M+K-H2O]+ -3.8139344 20.952042220 1 1
30 [M-CO2H+H]+ -4.8139344 -43.989863780 1 1
31 [3M+H-H2O]+ -4.8139344 -17.003277800 3 1
32 [2M+H]+ -1.2239848 1.007276000 2 1
33 [3M+H]+ -2.2698664 1.007276000 3 1
34 [2M+Na-H2O]+ -3.8139344 4.978142219 2 1
35 [2M+K-H2O]+ -3.8139344 20.952042220 2 1
36 [3M+K-H2O]+ -4.8139344 20.952042220 3 1
37 [2M+Na]+ -2.9688364 22.989218000 2 1
38 [2M+K]+ -3.8139344 38.963142220 2 1
39 [3M+K]+ -3.8139344 38.963142220 3 1
[1] -1.31290442 -1.31290442 -1.31290442 -1.13681316 0.38606558 -0.49999107
[7] -1.61393442 -0.03415082 -0.46780638 -1.31290442 -1.31290442 1.93100135
[13] 1.45239151 1.23671182 0.61137486 0.34030809 0.30514367 0.28915557
[19] -0.12257272 -0.21599441 -0.29171512 -0.91496441 -1.01187443 -1.01187443
[25] -1.31290442 -1.31290442 -1.31290442 -1.31290442 -1.61393442 -2.61393442
[31] -2.61393442 0.97601518 -0.06986637 -1.61393442 -1.61393442 -2.61393442
[37] -0.76883638 -1.61393442 -1.61393442
Beggining value of logl is -722.284
Aggregate cliques done, with 162 rounds
Kernighan-Lin done with 1 rounds
Finishing value of logl is -171.213
[ FAIL 0 | WARN 0 | SKIP 0 | PASS 14 ]
>
> proc.time()
user system elapsed
20.31 0.73 21.14
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cliqueMS.Rcheck/examples_i386/cliqueMS-Ex.timings
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cliqueMS.Rcheck/examples_x64/cliqueMS-Ex.timings
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