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BioC 2.14: CHECK report for ChemmineR on petty

This page was generated on 2014-10-08 08:58:29 -0700 (Wed, 08 Oct 2014).

Package 138/824HostnameOS / ArchINSTALLBUILDCHECKBUILD BIN
ChemmineR 2.16.9
ChemmineR Team
Snapshot Date: 2014-10-07 17:20:37 -0700 (Tue, 07 Oct 2014)
URL: https://hedgehog.fhcrc.org/bioconductor/branches/RELEASE_2_14/madman/Rpacks/ChemmineR
Last Changed Rev: 93217 / Revision: 95116
Last Changed Date: 2014-08-06 10:10:09 -0700 (Wed, 06 Aug 2014)
zin2 Linux (Ubuntu 12.04.4 LTS) / x86_64  OK  OK  OK 
moscato2 Windows Server 2008 R2 Enterprise SP1 (64-bit) / x64  OK  OK  OK  OK 
petty Mac OS X Snow Leopard (10.6.8) / x86_64  OK  OK [ OK ] OK 
morelia Mac OS X Mavericks (10.9.5) / x86_64  OK  OK  WARNINGS  OK 

Summary

Package: ChemmineR
Version: 2.16.9
Command: /Library/Frameworks/R.framework/Versions/Current/Resources/bin/R CMD check --no-vignettes --timings --no-multiarch ChemmineR_2.16.9.tar.gz
StartedAt: 2014-10-07 21:12:13 -0700 (Tue, 07 Oct 2014)
EndedAt: 2014-10-07 21:16:23 -0700 (Tue, 07 Oct 2014)
EllapsedTime: 250.6 seconds
RetCode: 0
Status:  OK 
CheckDir: ChemmineR.Rcheck
Warnings: 0

Command output

##############################################################################
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###
### Running command:
###
###   /Library/Frameworks/R.framework/Versions/Current/Resources/bin/R CMD check --no-vignettes --timings --no-multiarch ChemmineR_2.16.9.tar.gz
###
##############################################################################
##############################################################################


* using log directory ‘/Users/biocbuild/bbs-2.14-bioc/meat/ChemmineR.Rcheck’
* using R version 3.1.1 (2014-07-10)
* using platform: x86_64-apple-darwin10.8.0 (64-bit)
* using session charset: UTF-8
* using option ‘--no-vignettes’
* checking for file ‘ChemmineR/DESCRIPTION’ ... OK
* checking extension type ... Package
* this is package ‘ChemmineR’ version ‘2.16.9’
* 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 for sufficient/correct file permissions ... OK
* checking whether package ‘ChemmineR’ can be installed ... [17s/18s] OK
* checking installed package size ... OK
* checking package directory ... OK
* checking ‘build’ directory ... OK
* checking DESCRIPTION meta-information ... NOTE
Packages listed in more than one of Depends, Imports, Suggests, Enhances:
  ‘methods’ ‘ChemmineOB’
A package should be listed in only one of these fields.
* 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
* 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: ‘BiocGenerics’
  All declared Imports should be used.
See the information on DESCRIPTION files in the chapter ‘Creating R
packages’ of the ‘Writing R Extensions’ manual.
* checking S3 generic/method consistency ... OK
* checking replacement functions ... OK
* checking foreign function calls ... OK
* checking R code for possible problems ... NOTE
Found the following possibly unsafe calls:
File ‘ChemmineR/R/sim.R’:
  unlockBinding(".progress_bar_int_cnt", environment(.progress_bar))

Error in validObject(.Object) : 
  invalid class “ObjectsWithPackage” object: superclass "EnumerationValue" not defined in the environment of the object's class
Calls: <Anonymous> ... metaNameUndo -> new -> initialize -> initialize -> validObject
Execution halted
* 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 portable use of $(BLAS_LIBS) and $(LAPACK_LIBS) ... OK
* checking compiled code ... NOTE
File ‘/Users/biocbuild/bbs-2.14-bioc/meat/ChemmineR.Rcheck/ChemmineR/libs/ChemmineR.so’:
  Found ‘__ZSt4cerr’, possibly from ‘std::cerr’ (C++)
    Objects: ‘desc.o’, ‘formats.o’, ‘script.o’
  Found ‘__ZSt4cout’, possibly from ‘std::cout’ (C++)
    Object: ‘cluster.o’

Compiled code should not call entry points which might terminate R nor
write to stdout/stderr instead of to the console.

See ‘Writing portable packages’ in the ‘Writing R Extensions’ manual.
* checking installed files from ‘inst/doc’ ... OK
* checking files in ‘vignettes’ ... OK
* checking examples ... [82s/83s] OK
Examples with CPU or elapsed time > 5s
                user system elapsed
jarvisPatrick  7.494  0.033   7.543
addNewFeatures 6.529  0.200   6.972
loadSdf        6.264  0.075   6.451
findCompounds  5.454  0.055   5.551
* checking for unstated dependencies in tests ... OK
* checking tests ...
  Running ‘runTests.R’ [39s/43s]
 [40s/43s] OK
* checking for unstated dependencies in vignettes ... NOTE
'::' or ':::' import not declared from: ‘RefManageR’
* 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

NOTE: There were 5 notes.
See
  ‘/Users/biocbuild/bbs-2.14-bioc/meat/ChemmineR.Rcheck/00check.log’
for details.

ChemmineR.Rcheck/00install.out:

* installing *source* package ‘ChemmineR’ ...
** libs
llvm-g++-4.2 -arch x86_64 -I/Library/Frameworks/R.framework/Resources/include -DNDEBUG  -I/usr/local/include   -DNO_MAIN -DNO_DEBUG -fPIC  -mtune=core2 -g -O2 -Wall  -c DisjointSets.cpp -o DisjointSets.o
llvm-g++-4.2 -arch x86_64 -I/Library/Frameworks/R.framework/Resources/include -DNDEBUG  -I/usr/local/include   -DNO_MAIN -DNO_DEBUG -fPIC  -mtune=core2 -g -O2 -Wall  -c cluster.cc -o cluster.o
cluster.cc: In function ‘int nbr_intersect(std::vector<int, std::allocator<int> >&, std::vector<int, std::allocator<int> >&)’:
cluster.cc:118: warning: comparison between signed and unsigned integer expressions
cluster.cc:118: warning: comparison between signed and unsigned integer expressions
cluster.cc: In function ‘int contains(int, std::vector<int, std::allocator<int> >&)’:
cluster.cc:131: warning: comparison between signed and unsigned integer expressions
cluster.cc: In function ‘DisjointSets cluster(int, int, int, int)’:
cluster.cc:267: warning: comparison between signed and unsigned integer expressions
cluster.cc: In function ‘void loadNNMatrix(int, int, int, SEXPREC*)’:
cluster.cc:284: warning: comparison between signed and unsigned integer expressions
cluster.cc:298: warning: comparison between signed and unsigned integer expressions
cluster.cc: In function ‘void loadNNList(int, int, SEXPREC*)’:
cluster.cc:314: warning: comparison between signed and unsigned integer expressions
cluster.cc:332: warning: comparison between signed and unsigned integer expressions
cluster.cc: In function ‘SEXPREC* jarvis_patrick(SEXPREC*, SEXPREC*, SEXPREC*, SEXPREC*, SEXPREC*)’:
cluster.cc:390: warning: comparison between signed and unsigned integer expressions
cluster.cc: At global scope:
cluster.cc:49: warning: ‘void prepare_neighbors(const char*, int, int)’ defined but not used
llvm-g++-4.2 -arch x86_64 -I/Library/Frameworks/R.framework/Resources/include -DNDEBUG  -I/usr/local/include   -DNO_MAIN -DNO_DEBUG -fPIC  -mtune=core2 -g -O2 -Wall  -c desc.cc -o desc.o
desc.cc: In function ‘SEXPREC* genAPDescriptor(SEXPREC*)’:
desc.cc:249: warning: comparison between signed and unsigned integer expressions
llvm-g++-4.2 -arch x86_64 -I/Library/Frameworks/R.framework/Resources/include -DNDEBUG  -I/usr/local/include   -DNO_MAIN -DNO_DEBUG -fPIC  -mtune=core2 -g -O2 -Wall  -c formats.cc -o formats.o
llvm-g++-4.2 -arch x86_64 -I/Library/Frameworks/R.framework/Resources/include -DNDEBUG  -I/usr/local/include   -DNO_MAIN -DNO_DEBUG -fPIC  -mtune=core2 -g -O2 -Wall  -c molecule.cc -o molecule.o
llvm-g++-4.2 -arch x86_64 -I/Library/Frameworks/R.framework/Resources/include -DNDEBUG  -I/usr/local/include   -DNO_MAIN -DNO_DEBUG -fPIC  -mtune=core2 -g -O2 -Wall  -c r_wrap.cc -o r_wrap.o
llvm-g++-4.2 -arch x86_64 -I/Library/Frameworks/R.framework/Resources/include -DNDEBUG  -I/usr/local/include   -DNO_MAIN -DNO_DEBUG -fPIC  -mtune=core2 -g -O2 -Wall  -c script.cc -o script.o
desc.h:39: warning: ‘elements’ defined but not used
llvm-g++-4.2 -arch x86_64 -I/Library/Frameworks/R.framework/Resources/include -DNDEBUG  -I/usr/local/include   -DNO_MAIN -DNO_DEBUG -fPIC  -mtune=core2 -g -O2 -Wall  -c similarity.cc -o similarity.o
desc.h:39: warning: ‘elements’ defined but not used
llvm-g++-4.2 -arch x86_64 -dynamiclib -Wl,-headerpad_max_install_names -undefined dynamic_lookup -single_module -multiply_defined suppress -L/usr/local/lib -L/usr/local/lib -o ChemmineR.so DisjointSets.o cluster.o desc.o formats.o molecule.o r_wrap.o script.o similarity.o -F/Library/Frameworks/R.framework/.. -framework R -Wl,-framework -Wl,CoreFoundation
installing to /Users/biocbuild/bbs-2.14-bioc/meat/ChemmineR.Rcheck/ChemmineR/libs
** R
** data
** inst
** preparing package for lazy loading
Creating a generic function for ‘as.vector’ from package ‘base’ in package ‘ChemmineR’
Creating a generic function for ‘as.matrix’ from package ‘base’ in package ‘ChemmineR’
Creating a generic function for ‘plot’ from package ‘graphics’ in package ‘ChemmineR’
Creating a generic function for ‘print’ from package ‘base’ in package ‘ChemmineR’
** help
*** installing help indices
** building package indices
** installing vignettes
** testing if installed package can be loaded
* DONE (ChemmineR)

ChemmineR.Rcheck/ChemmineR-Ex.timings:

nameusersystemelapsed
AP-class1.3820.1211.522
APset-class1.1450.1181.267
FP-class0.1530.0030.156
FPset-class0.7260.0360.763
SDF-class0.1350.0110.146
SDF2apcmp0.1400.0010.142
SDFset-class0.9440.0501.001
SDFset2SDF0.2820.0130.294
SDFset2list0.1500.0530.203
SDFstr-class0.7900.0100.801
SMI-class0.0070.0010.007
SMIset-class0.0160.0020.018
addDescriptorType0.0010.0000.001
addNewFeatures6.5290.2006.972
ap0.6850.0210.707
apfp0.0050.0010.006
apset0.0110.0020.013
apset2descdb1.2200.1151.337
atomblock0.2610.0250.285
atomcount0.4760.0070.484
atomprop0.0080.0010.008
atomsubset0.0600.0020.061
batchByIndex0.0020.0000.002
bondblock0.2580.0160.275
bonds0.0660.0030.070
bufferLines0.0010.0000.001
bufferResultSet0.0030.0010.003
byCluster1.8200.0071.834
cid0.0920.0020.093
cluster.sizestat1.1900.0081.201
cluster.visualize1.5980.0111.614
cmp.cluster4.4590.0354.688
cmp.duplicated0.0870.0010.089
cmp.parse0.0480.0010.051
cmp.parse10.0020.0010.002
cmp.search1.5010.0171.522
cmp.similarity0.0450.0020.047
conMA0.1220.0140.138
datablock0.7820.0140.797
datablock2ma0.0880.0030.091
db.explain0.1440.0110.155
db.subset0.0070.0010.009
dbTransaction0.1230.0130.155
desc2fp0.3100.0100.319
findCompounds5.4540.0555.551
findCompoundsByName1.0160.0271.059
fingerprintOB0.0010.0000.001
fold0.0040.0010.004
foldCount0.0030.0000.003
fp2bit1.6100.0261.638
fpSim1.6470.0231.674
fptype0.0030.0000.002
fromNNMatrix1.7880.0071.797
genAPDescriptors0.0490.0010.049
getCompoundNames0.9170.0230.957
getCompounds0.9960.0251.036
getIds0.0010.0000.001
grepSDFset0.1140.0010.116
groups0.2830.0080.292
header0.2610.0050.266
initDb0.1270.0120.150
jarvisPatrick7.4940.0337.543
listFeatures0.9750.0221.013
loadSdf6.2640.0756.451
makeUnique0.0420.0010.044
maximallyDissimilar0.7720.0030.776
nearestNeighbors3.3630.0093.392
numBits0.0030.0000.002
obmol1.4720.0431.539
parBatchByIndex0.0020.0010.002
plotStruc0.7220.0110.736
propOB0.0010.0010.001
pubchemFPencoding0.0060.0000.007
read.AP0.0350.0010.036
read.SDFindex0.0340.0010.036
read.SDFset1.4210.0041.428
read.SDFstr2.1990.0082.231
read.SMIset0.0040.0010.005
regenerateCoords0.0010.0000.001
rings1.2340.0181.269
sdf.subset0.0010.0000.002
sdf.visualize0.0350.0010.037
sdf2ap1.3100.1161.429
sdf2list0.0510.0160.067
sdf2smiles0.0010.0000.001
sdf2str0.0700.0070.077
sdfStream0.0400.0020.041
sdfid0.0400.0010.042
sdfsample0.1140.0050.119
sdfstr2list2.9760.5573.604
searchSim0.0020.0000.002
searchString0.0010.0000.002
selectInBatches0.0040.0010.004
setPriorities0.0010.0000.001
smartsSearchOB0.0010.0000.001
smiles2sdf0.0010.0000.002
smisample0.0080.0010.009
trimNeighbors4.3700.0084.389
validSDF0.0470.0010.049
view0.2330.0060.238
write.SDF0.4530.0090.461
write.SDFsplit0.0330.0020.035
write.SMI0.0040.0000.004