Back to Multiple platform build/check report for BioC 3.20: simplified long |
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This page was generated on 2024-06-11 15:41 -0400 (Tue, 11 Jun 2024).
Hostname | OS | Arch (*) | R version | Installed pkgs |
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nebbiolo2 | Linux (Ubuntu 22.04.3 LTS) | x86_64 | 4.4.0 RC (2024-04-16 r86468) -- "Puppy Cup" | 4679 |
palomino4 | Windows Server 2022 Datacenter | x64 | 4.4.0 RC (2024-04-16 r86468 ucrt) -- "Puppy Cup" | 4414 |
merida1 | macOS 12.7.4 Monterey | x86_64 | 4.4.0 Patched (2024-04-24 r86482) -- "Puppy Cup" | 4441 |
kjohnson1 | macOS 13.6.6 Ventura | arm64 | 4.4.0 Patched (2024-04-24 r86482) -- "Puppy Cup" | 4394 |
Click on any hostname to see more info about the system (e.g. compilers) (*) as reported by 'uname -p', except on Windows and Mac OS X |
Package 320/2239 | Hostname | OS / Arch | INSTALL | BUILD | CHECK | BUILD BIN | ||||||||
ChemmineOB 1.43.0 (landing page) Thomas Girke
| nebbiolo2 | Linux (Ubuntu 22.04.3 LTS) / x86_64 | OK | OK | WARNINGS | |||||||||
palomino4 | Windows Server 2022 Datacenter / x64 | OK | OK | WARNINGS | OK | |||||||||
merida1 | macOS 12.7.4 Monterey / x86_64 | OK | OK | WARNINGS | OK | |||||||||
kjohnson1 | macOS 13.6.6 Ventura / arm64 | ERROR | ERROR | skipped | skipped | |||||||||
To the developers/maintainers of the ChemmineOB package: - Allow up to 24 hours (and sometimes 48 hours) for your latest push to git@git.bioconductor.org:packages/ChemmineOB.git to reflect on this report. See Troubleshooting Build Report for more information. - Use the following Renviron settings to reproduce errors and warnings. - If 'R CMD check' started to fail recently on the Linux builder(s) over a missing dependency, add the missing dependency to 'Suggests:' in your DESCRIPTION file. See Renviron.bioc for more information. |
Package: ChemmineOB |
Version: 1.43.0 |
Command: /Library/Frameworks/R.framework/Resources/bin/R CMD check --install=check:ChemmineOB.install-out.txt --library=/Library/Frameworks/R.framework/Resources/library --no-vignettes --timings ChemmineOB_1.43.0.tar.gz |
StartedAt: 2024-06-10 01:09:04 -0400 (Mon, 10 Jun 2024) |
EndedAt: 2024-06-10 01:13:18 -0400 (Mon, 10 Jun 2024) |
EllapsedTime: 254.1 seconds |
RetCode: 0 |
Status: WARNINGS |
CheckDir: ChemmineOB.Rcheck |
Warnings: 2 |
############################################################################## ############################################################################## ### ### Running command: ### ### /Library/Frameworks/R.framework/Resources/bin/R CMD check --install=check:ChemmineOB.install-out.txt --library=/Library/Frameworks/R.framework/Resources/library --no-vignettes --timings ChemmineOB_1.43.0.tar.gz ### ############################################################################## ############################################################################## * using log directory ‘/Users/biocbuild/bbs-3.20-bioc/meat/ChemmineOB.Rcheck’ * using R version 4.4.0 Patched (2024-04-24 r86482) * using platform: x86_64-apple-darwin20 * R was compiled by Apple clang version 14.0.0 (clang-1400.0.29.202) GNU Fortran (GCC) 12.2.0 * running under: macOS Monterey 12.7.4 * using session charset: UTF-8 * using option ‘--no-vignettes’ * checking for file ‘ChemmineOB/DESCRIPTION’ ... OK * checking extension type ... Package * this is package ‘ChemmineOB’ version ‘1.43.0’ * 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 ‘ChemmineOB’ can be installed ... OK * used C++ compiler: ‘Apple clang version 14.0.0 (clang-1400.0.29.202)’ * used SDK: ‘MacOSX11.3.sdk’ * checking installed package size ... NOTE installed size is 9.7Mb sub-directories of 1Mb or more: R 3.9Mb libs 3.7Mb openbabel_data 2.0Mb * checking package directory ... OK * checking ‘build’ directory ... OK * checking DESCRIPTION meta-information ... NOTE Package listed in more than one of Depends, Imports, Suggests, Enhances: ‘ChemmineR’ A package should be listed in only one of these fields. * checking top-level files ... NOTE File LICENSE is not mentioned in the DESCRIPTION file. * checking for left-over files ... OK * checking index information ... OK * checking package subdirectories ... OK * checking code 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 whether startup messages can be suppressed ... OK * checking dependencies in R code ... NOTE Namespaces in Imports field not imported from: ‘BiocGenerics’ ‘Rcpp’ All declared Imports should be used. * checking S3 generic/method consistency ... OK * checking replacement functions ... OK * checking foreign function calls ... WARNING Foreign function calls without 'PACKAGE' argument: .Call("R_SWIG_R_pushCallbackFunctionData", ...) .Call("R_SWIG_debug_getCallbackFunctionData", ...) See chapter ‘System and foreign language interfaces’ in the ‘Writing R Extensions’ manual. * checking R code for possible problems ... NOTE cerr: no visible global function definition for ‘cerr_set’ cin: no visible global function definition for ‘cin_set’ clog: no visible global function definition for ‘clog_set’ cout: no visible global function definition for ‘cout_set’ delete,_p_OpenBabel__AliasData: no visible global function definition for ‘delete_OpenBabel__AliasData’ delete,_p_OpenBabel__CharPtrLess: no visible global function definition for ‘delete_OpenBabel__CharPtrLess’ delete,_p_OpenBabel__FastSearch: no visible global function definition for ‘delete_OpenBabel__FastSearch’ delete,_p_OpenBabel__FastSearchIndexer: no visible global function definition for ‘delete_OpenBabel__FastSearchIndexer’ delete,_p_OpenBabel__FptIndexHeader: no visible global function definition for ‘delete_OpenBabel__FptIndexHeader’ delete,_p_OpenBabel__LineSearchType: no visible global function definition for ‘delete_OpenBabel__LineSearchType’ delete,_p_OpenBabel__OBAlign: no visible global function definition for ‘delete_OpenBabel__OBAlign’ delete,_p_OpenBabel__OBAngle: no visible global function definition for ‘delete_OpenBabel__OBAngle’ delete,_p_OpenBabel__OBAngleData: no visible global function definition for ‘delete_OpenBabel__OBAngleData’ delete,_p_OpenBabel__OBAromaticTyper: no visible global function definition for ‘delete_OpenBabel__OBAromaticTyper’ delete,_p_OpenBabel__OBAtom: no visible global function definition for ‘delete_OpenBabel__OBAtom’ delete,_p_OpenBabel__OBAtomAtomIter: no visible global function definition for ‘delete_OpenBabel__OBAtomAtomIter’ delete,_p_OpenBabel__OBAtomBondIter: no visible global function definition for ‘delete_OpenBabel__OBAtomBondIter’ delete,_p_OpenBabel__OBAtomHOF: no visible global function definition for ‘delete_OpenBabel__OBAtomHOF’ delete,_p_OpenBabel__OBAtomTyper: no visible global function definition for ‘delete_OpenBabel__OBAtomTyper’ delete,_p_OpenBabel__OBAtomicHeatOfFormationTable: no visible global function definition for ‘delete_OpenBabel__OBAtomicHeatOfFormationTable’ delete,_p_OpenBabel__OBBase: no visible global function definition for ‘delete_OpenBabel__OBBase’ delete,_p_OpenBabel__OBBitVec: no visible global function definition for ‘delete_OpenBabel__OBBitVec’ delete,_p_OpenBabel__OBBond: no visible global function definition for ‘delete_OpenBabel__OBBond’ delete,_p_OpenBabel__OBBuilder: no visible global function definition for ‘delete_OpenBabel__OBBuilder’ delete,_p_OpenBabel__OBChainsParser: no visible global function definition for ‘delete_OpenBabel__OBChainsParser’ delete,_p_OpenBabel__OBChargeModel: no visible global function definition for ‘delete_OpenBabel__OBChargeModel’ delete,_p_OpenBabel__OBCisTransConfig: no visible global function definition for ‘delete_OpenBabel__OBCisTransConfig’ delete,_p_OpenBabel__OBCisTransStereo: no visible global function definition for ‘delete_OpenBabel__OBCisTransStereo’ delete,_p_OpenBabel__OBCommentData: no visible global function definition for ‘delete_OpenBabel__OBCommentData’ delete,_p_OpenBabel__OBConformerData: no visible global function definition for ‘delete_OpenBabel__OBConformerData’ delete,_p_OpenBabel__OBConformerFilter: no visible global function definition for ‘delete_OpenBabel__OBConformerFilter’ delete,_p_OpenBabel__OBConformerFilters: no visible global function definition for ‘delete_OpenBabel__OBConformerFilters’ delete,_p_OpenBabel__OBConformerScore: no visible global function definition for ‘delete_OpenBabel__OBConformerScore’ delete,_p_OpenBabel__OBConformerSearch: no visible global function definition for ‘delete_OpenBabel__OBConformerSearch’ delete,_p_OpenBabel__OBConversion: no visible global function definition for ‘delete_OpenBabel__OBConversion’ delete,_p_OpenBabel__OBDOSData: no visible global function definition for ‘delete_OpenBabel__OBDOSData’ delete,_p_OpenBabel__OBDescriptor: no visible global function definition for ‘delete_OpenBabel__OBDescriptor’ delete,_p_OpenBabel__OBElectronicTransitionData: no visible global function definition for ‘delete_OpenBabel__OBElectronicTransitionData’ delete,_p_OpenBabel__OBEnergyConformerScore: no visible global function definition for ‘delete_OpenBabel__OBEnergyConformerScore’ delete,_p_OpenBabel__OBError: no visible global function definition for ‘delete_OpenBabel__OBError’ delete,_p_OpenBabel__OBExternalBond: no visible global function definition for ‘delete_OpenBabel__OBExternalBond’ delete,_p_OpenBabel__OBExternalBondData: no visible global function definition for ‘delete_OpenBabel__OBExternalBondData’ delete,_p_OpenBabel__OBFFCalculation2: no visible global function definition for ‘delete_OpenBabel__OBFFCalculation2’ delete,_p_OpenBabel__OBFFCalculation3: no visible global function definition for ‘delete_OpenBabel__OBFFCalculation3’ delete,_p_OpenBabel__OBFFCalculation4: no visible global function definition for ‘delete_OpenBabel__OBFFCalculation4’ delete,_p_OpenBabel__OBFFConstraint: no visible global function definition for ‘delete_OpenBabel__OBFFConstraint’ delete,_p_OpenBabel__OBFFConstraints: no visible global function definition for ‘delete_OpenBabel__OBFFConstraints’ delete,_p_OpenBabel__OBFFParameter: no visible global function definition for ‘delete_OpenBabel__OBFFParameter’ delete,_p_OpenBabel__OBFingerprint: no visible global function definition for ‘delete_OpenBabel__OBFingerprint’ delete,_p_OpenBabel__OBForceField: no visible global function definition for ‘delete_OpenBabel__OBForceField’ delete,_p_OpenBabel__OBFormat: no visible global function definition for ‘delete_OpenBabel__OBFormat’ delete,_p_OpenBabel__OBFreeGrid: no visible global function definition for ‘delete_OpenBabel__OBFreeGrid’ delete,_p_OpenBabel__OBFreeGridPoint: no visible global function definition for ‘delete_OpenBabel__OBFreeGridPoint’ delete,_p_OpenBabel__OBGenericData: no visible global function definition for ‘delete_OpenBabel__OBGenericData’ delete,_p_OpenBabel__OBGlobalDataBase: no visible global function definition for ‘delete_OpenBabel__OBGlobalDataBase’ delete,_p_OpenBabel__OBGraphSym: no visible global function definition for ‘delete_OpenBabel__OBGraphSym’ delete,_p_OpenBabel__OBGridData: no visible global function definition for ‘delete_OpenBabel__OBGridData’ delete,_p_OpenBabel__OBInternalCoord: no visible global function definition for ‘delete_OpenBabel__OBInternalCoord’ delete,_p_OpenBabel__OBIsomorphismMapper: no visible global function definition for ‘delete_OpenBabel__OBIsomorphismMapper’ delete,_p_OpenBabel__OBMatrixData: no visible global function definition for ‘delete_OpenBabel__OBMatrixData’ delete,_p_OpenBabel__OBMessageHandler: no visible global function definition for ‘delete_OpenBabel__OBMessageHandler’ delete,_p_OpenBabel__OBMinimizingEnergyConformerScore: no visible global function definition for ‘delete_OpenBabel__OBMinimizingEnergyConformerScore’ delete,_p_OpenBabel__OBMinimizingRMSDConformerScore: no visible global function definition for ‘delete_OpenBabel__OBMinimizingRMSDConformerScore’ delete,_p_OpenBabel__OBMol: no visible global function definition for ‘delete_OpenBabel__OBMol’ delete,_p_OpenBabel__OBMolAngleIter: no visible global function definition for ‘delete_OpenBabel__OBMolAngleIter’ delete,_p_OpenBabel__OBMolAtomBFSIter: no visible global function definition for ‘delete_OpenBabel__OBMolAtomBFSIter’ delete,_p_OpenBabel__OBMolAtomDFSIter: no visible global function definition for ‘delete_OpenBabel__OBMolAtomDFSIter’ delete,_p_OpenBabel__OBMolAtomIter: no visible global function definition for ‘delete_OpenBabel__OBMolAtomIter’ delete,_p_OpenBabel__OBMolBondBFSIter: no visible global function definition for ‘delete_OpenBabel__OBMolBondBFSIter’ delete,_p_OpenBabel__OBMolBondIter: no visible global function definition for ‘delete_OpenBabel__OBMolBondIter’ delete,_p_OpenBabel__OBMolPairIter: no visible global function definition for ‘delete_OpenBabel__OBMolPairIter’ delete,_p_OpenBabel__OBMolRingIter: no visible global function definition for ‘delete_OpenBabel__OBMolRingIter’ delete,_p_OpenBabel__OBMolTorsionIter: no visible global function definition for ‘delete_OpenBabel__OBMolTorsionIter’ delete,_p_OpenBabel__OBOp: no visible global function definition for ‘delete_OpenBabel__OBOp’ delete,_p_OpenBabel__OBOrbital: no visible global function definition for ‘delete_OpenBabel__OBOrbital’ delete,_p_OpenBabel__OBOrbitalData: no visible global function definition for ‘delete_OpenBabel__OBOrbitalData’ delete,_p_OpenBabel__OBPairData: no visible global function definition for ‘delete_OpenBabel__OBPairData’ delete,_p_OpenBabel__OBPcharge: no visible global function definition for ‘delete_OpenBabel__OBPcharge’ delete,_p_OpenBabel__OBPlugin: no visible global function definition for ‘delete_OpenBabel__OBPlugin’ delete,_p_OpenBabel__OBQuery: no visible global function definition for ‘delete_OpenBabel__OBQuery’ delete,_p_OpenBabel__OBQueryAtom: no visible global function definition for ‘delete_OpenBabel__OBQueryAtom’ delete,_p_OpenBabel__OBQueryBond: no visible global function definition for ‘delete_OpenBabel__OBQueryBond’ delete,_p_OpenBabel__OBRMSDConformerScore: no visible global function definition for ‘delete_OpenBabel__OBRMSDConformerScore’ delete,_p_OpenBabel__OBRTree: no visible global function definition for ‘delete_OpenBabel__OBRTree’ delete,_p_OpenBabel__OBReaction: no visible global function definition for ‘delete_OpenBabel__OBReaction’ delete,_p_OpenBabel__OBResidue: no visible global function definition for ‘delete_OpenBabel__OBResidue’ delete,_p_OpenBabel__OBResidueAtomIter: no visible global function definition for ‘delete_OpenBabel__OBResidueAtomIter’ delete,_p_OpenBabel__OBResidueData: no visible global function definition for ‘delete_OpenBabel__OBResidueData’ delete,_p_OpenBabel__OBResidueIter: no visible global function definition for ‘delete_OpenBabel__OBResidueIter’ delete,_p_OpenBabel__OBRing: no visible global function definition for ‘delete_OpenBabel__OBRing’ delete,_p_OpenBabel__OBRingData: no visible global function definition for ‘delete_OpenBabel__OBRingData’ delete,_p_OpenBabel__OBRingSearch: no visible global function definition for ‘delete_OpenBabel__OBRingSearch’ delete,_p_OpenBabel__OBRingTyper: no visible global function definition for ‘delete_OpenBabel__OBRingTyper’ delete,_p_OpenBabel__OBRotamerList: no visible global function definition for ‘delete_OpenBabel__OBRotamerList’ delete,_p_OpenBabel__OBRotationData: no visible global function definition for ‘delete_OpenBabel__OBRotationData’ delete,_p_OpenBabel__OBRotor: no visible global function definition for ‘delete_OpenBabel__OBRotor’ delete,_p_OpenBabel__OBRotorKeys: no visible global function definition for ‘delete_OpenBabel__OBRotorKeys’ delete,_p_OpenBabel__OBRotorList: no visible global function definition for ‘delete_OpenBabel__OBRotorList’ delete,_p_OpenBabel__OBRotorRule: no visible global function definition for ‘delete_OpenBabel__OBRotorRule’ delete,_p_OpenBabel__OBRotorRules: no visible global function definition for ‘delete_OpenBabel__OBRotorRules’ delete,_p_OpenBabel__OBSSMatch: no visible global function definition for ‘delete_OpenBabel__OBSSMatch’ delete,_p_OpenBabel__OBSerialNums: no visible global function definition for ‘delete_OpenBabel__OBSerialNums’ delete,_p_OpenBabel__OBSetData: no visible global function definition for ‘delete_OpenBabel__OBSetData’ delete,_p_OpenBabel__OBSmartsMatcher: no visible global function definition for ‘delete_OpenBabel__OBSmartsMatcher’ delete,_p_OpenBabel__OBSmartsPattern: no visible global function definition for ‘delete_OpenBabel__OBSmartsPattern’ delete,_p_OpenBabel__OBSpectrophore: no visible global function definition for ‘delete_OpenBabel__OBSpectrophore’ delete,_p_OpenBabel__OBSqrtTbl: no visible global function definition for ‘delete_OpenBabel__OBSqrtTbl’ delete,_p_OpenBabel__OBSquarePlanarConfig: no visible global function definition for ‘delete_OpenBabel__OBSquarePlanarConfig’ delete,_p_OpenBabel__OBSquarePlanarStereo: no visible global function definition for ‘delete_OpenBabel__OBSquarePlanarStereo’ delete,_p_OpenBabel__OBStereo: no visible global function definition for ‘delete_OpenBabel__OBStereo’ delete,_p_OpenBabel__OBStereoBase: no visible global function definition for ‘delete_OpenBabel__OBStereoBase’ delete,_p_OpenBabel__OBStereoFacade: no visible global function definition for ‘delete_OpenBabel__OBStereoFacade’ delete,_p_OpenBabel__OBStereoUnit: no visible global function definition for ‘delete_OpenBabel__OBStereoUnit’ delete,_p_OpenBabel__OBStericConformerFilter: no visible global function definition for ‘delete_OpenBabel__OBStericConformerFilter’ delete,_p_OpenBabel__OBStopwatch: no visible global function definition for ‘delete_OpenBabel__OBStopwatch’ delete,_p_OpenBabel__OBSymmetryData: no visible global function definition for ‘delete_OpenBabel__OBSymmetryData’ delete,_p_OpenBabel__OBTetraNonPlanarStereo: no visible global function definition for ‘delete_OpenBabel__OBTetraNonPlanarStereo’ delete,_p_OpenBabel__OBTetraPlanarStereo: no visible global function definition for ‘delete_OpenBabel__OBTetraPlanarStereo’ delete,_p_OpenBabel__OBTetrahedralConfig: no visible global function definition for ‘delete_OpenBabel__OBTetrahedralConfig’ delete,_p_OpenBabel__OBTetrahedralStereo: no visible global function definition for ‘delete_OpenBabel__OBTetrahedralStereo’ delete,_p_OpenBabel__OBTorsion: no visible global function definition for ‘delete_OpenBabel__OBTorsion’ delete,_p_OpenBabel__OBTorsionData: no visible global function definition for ‘delete_OpenBabel__OBTorsionData’ delete,_p_OpenBabel__OBTypeTable: no visible global function definition for ‘delete_OpenBabel__OBTypeTable’ delete,_p_OpenBabel__OBUnitCell: no visible global function definition for ‘delete_OpenBabel__OBUnitCell’ delete,_p_OpenBabel__OBVectorData: no visible global function definition for ‘delete_OpenBabel__OBVectorData’ delete,_p_OpenBabel__OBVibrationData: no visible global function definition for ‘delete_OpenBabel__OBVibrationData’ delete,_p_OpenBabel__OBVirtualBond: no visible global function definition for ‘delete_OpenBabel__OBVirtualBond’ delete,_p_OpenBabel__SpaceGroup: no visible global function definition for ‘delete_OpenBabel__SpaceGroup’ delete,_p_OpenBabel__matrix3x3: no visible global function definition for ‘delete_OpenBabel__matrix3x3’ delete,_p_OpenBabel__obLogBuf: no visible global function definition for ‘delete_OpenBabel__obLogBuf’ delete,_p_OpenBabel__rotor_digit: no visible global function definition for ‘delete_OpenBabel__rotor_digit’ delete,_p_OpenBabel__transform3d: no visible global function definition for ‘delete_OpenBabel__transform3d’ delete,_p_OpenBabel__vector3: no visible global function definition for ‘delete_OpenBabel__vector3’ delete,_p_std__basic_iosT_char_std__char_traitsT_char_t_t: no visible global function definition for ‘delete_std__basic_iosT_char_std__char_traitsT_char_t_t’ delete,_p_std__basic_iostreamT_char_std__char_traitsT_char_t_t: no visible global function definition for ‘delete_std__basic_iostreamT_char_std__char_traitsT_char_t_t’ delete,_p_std__basic_istreamT_char_std__char_traitsT_char_t_t: no visible global function definition for ‘delete_std__basic_istreamT_char_std__char_traitsT_char_t_t’ delete,_p_std__basic_ostreamT_char_std__char_traitsT_char_t_t: no visible global function definition for ‘delete_std__basic_ostreamT_char_std__char_traitsT_char_t_t’ delete,_p_std__binary_functionT_char_const_p_char_const_p_bool_t: no visible global function definition for ‘delete_std__binary_functionT_char_const_p_char_const_p_bool_t’ delete,_p_std__ios_base: no visible global function definition for ‘delete_std__ios_base’ delete,_p_std__pairT_unsigned_int_unsigned_int_t: no visible global function definition for ‘delete_std__pairT_unsigned_int_unsigned_int_t’ delete,_p_std__stringbuf: no visible global function definition for ‘delete_std__stringbuf’ delete,_p_std__vectorT_OpenBabel__OBBond_std__allocatorT_OpenBabel__OBBond_t_t: no visible global function definition for ‘delete_std__vectorT_OpenBabel__OBBond_std__allocatorT_OpenBabel__OBBond_t_t’ delete,_p_std__vectorT_OpenBabel__OBGenericData_p_std__allocatorT_OpenBabel__OBGenericData_p_t_t: no visible global function definition for ‘delete_std__vectorT_OpenBabel__OBGenericData_p_std__allocatorT_OpenBabel__OBGenericData_p_t_t’ delete,_p_std__vectorT_OpenBabel__OBInternalCoord_p_std__allocatorT_OpenBabel__OBInternalCoord_p_t_t: no visible global function definition for ‘delete_std__vectorT_OpenBabel__OBInternalCoord_p_std__allocatorT_OpenBabel__OBInternalCoord_p_t_t’ delete,_p_std__vectorT_OpenBabel__OBMol_std__allocatorT_OpenBabel__OBMol_t_t: no visible global function definition for ‘delete_std__vectorT_OpenBabel__OBMol_std__allocatorT_OpenBabel__OBMol_t_t’ delete,_p_std__vectorT_OpenBabel__OBResidue_std__allocatorT_OpenBabel__OBResidue_t_t: no visible global function definition for ‘delete_std__vectorT_OpenBabel__OBResidue_std__allocatorT_OpenBabel__OBResidue_t_t’ delete,_p_std__vectorT_OpenBabel__OBRing_p_std__allocatorT_OpenBabel__OBRing_p_t_t: no visible global function definition for ‘delete_std__vectorT_OpenBabel__OBRing_p_std__allocatorT_OpenBabel__OBRing_p_t_t’ delete,_p_std__vectorT_OpenBabel__OBRing_std__allocatorT_OpenBabel__OBRing_t_t: no visible global function definition for ‘delete_std__vectorT_OpenBabel__OBRing_std__allocatorT_OpenBabel__OBRing_t_t’ delete,_p_std__vectorT_OpenBabel__vector3_std__allocatorT_OpenBabel__vector3_t_t: no visible global function definition for ‘delete_std__vectorT_OpenBabel__vector3_std__allocatorT_OpenBabel__vector3_t_t’ delete,_p_std__vectorT_double_std__allocatorT_double_t_t: no visible global function definition for ‘delete_std__vectorT_double_std__allocatorT_double_t_t’ delete,_p_std__vectorT_int_std__allocatorT_int_t_t: no visible global function definition for ‘delete_std__vectorT_int_std__allocatorT_int_t_t’ delete,_p_std__vectorT_std__pairT_unsigned_int_unsigned_int_t_std__allocatorT_std__pairT_unsigned_int_unsigned_int_t_t_t: no visible global function definition for ‘delete_std__vectorT_std__pairT_unsigned_int_unsigned_int_t_std__allocatorT_std__pairT_unsigned_int_unsigned_int_t_t_t’ delete,_p_std__vectorT_std__string_std__allocatorT_std__string_t_t: no visible global function definition for ‘delete_std__vectorT_std__string_std__allocatorT_std__string_t_t’ delete,_p_std__vectorT_std__vectorT_OpenBabel__vector3_std__allocatorT_OpenBabel__vector3_t_t_std__allocatorT_std__vectorT_OpenBabel__vector3_std__allocatorT_OpenBabel__vector3_t_t_t_t: no visible global function definition for ‘delete_std__vectorT_std__vectorT_OpenBabel__vector3_std__allocatorT_OpenBabel__vector3_t_t_std__allocatorT_std__vectorT_OpenBabel__vector3_std__allocatorT_OpenBabel__vector3_t_t_t_t’ delete,_p_std__vectorT_std__vectorT_int_std__allocatorT_int_t_t_std__allocatorT_std__vectorT_int_std__allocatorT_int_t_t_t_t: no visible global function definition for ‘delete_std__vectorT_std__vectorT_int_std__allocatorT_int_t_t_std__allocatorT_std__vectorT_int_std__allocatorT_int_t_t_t_t’ delete,_p_std__vectorT_std__vectorT_std__pairT_unsigned_int_unsigned_int_t_std__allocatorT_std__pairT_unsigned_int_unsigned_int_t_t_t_std__allocatorT_std__vectorT_std__pairT_unsigned_int_unsigned_int_t_std__allocatorT_std__pairT_unsigned_int_unsigned_int_t_t_t_t_t: no visible global function definition for ‘delete_std__vectorT_std__vectorT_std__pairT_unsigned_int_unsigned_int_t_std__allocatorT_std__pairT_unsigned_int_unsigned_int_t_t_t_std__allocatorT_std__vectorT_std__pairT_unsigned_int_unsigned_int_t_std__allocatorT_std__pairT_unsigned_int_unsigned_int_t_t_t_t_t’ delete,_p_std__vectorT_unsigned_int_std__allocatorT_unsigned_int_t_t: no visible global function definition for ‘delete_std__vectorT_unsigned_int_std__allocatorT_unsigned_int_t_t’ Undefined global functions or variables: cerr_set cin_set clog_set cout_set delete_OpenBabel__AliasData delete_OpenBabel__CharPtrLess delete_OpenBabel__FastSearch delete_OpenBabel__FastSearchIndexer delete_OpenBabel__FptIndexHeader delete_OpenBabel__LineSearchType delete_OpenBabel__OBAlign delete_OpenBabel__OBAngle delete_OpenBabel__OBAngleData delete_OpenBabel__OBAromaticTyper delete_OpenBabel__OBAtom delete_OpenBabel__OBAtomAtomIter delete_OpenBabel__OBAtomBondIter delete_OpenBabel__OBAtomHOF delete_OpenBabel__OBAtomTyper delete_OpenBabel__OBAtomicHeatOfFormationTable delete_OpenBabel__OBBase delete_OpenBabel__OBBitVec delete_OpenBabel__OBBond delete_OpenBabel__OBBuilder delete_OpenBabel__OBChainsParser delete_OpenBabel__OBChargeModel delete_OpenBabel__OBCisTransConfig delete_OpenBabel__OBCisTransStereo delete_OpenBabel__OBCommentData delete_OpenBabel__OBConformerData delete_OpenBabel__OBConformerFilter delete_OpenBabel__OBConformerFilters delete_OpenBabel__OBConformerScore delete_OpenBabel__OBConformerSearch delete_OpenBabel__OBConversion delete_OpenBabel__OBDOSData delete_OpenBabel__OBDescriptor delete_OpenBabel__OBElectronicTransitionData delete_OpenBabel__OBEnergyConformerScore delete_OpenBabel__OBError delete_OpenBabel__OBExternalBond delete_OpenBabel__OBExternalBondData delete_OpenBabel__OBFFCalculation2 delete_OpenBabel__OBFFCalculation3 delete_OpenBabel__OBFFCalculation4 delete_OpenBabel__OBFFConstraint delete_OpenBabel__OBFFConstraints delete_OpenBabel__OBFFParameter delete_OpenBabel__OBFingerprint delete_OpenBabel__OBForceField delete_OpenBabel__OBFormat delete_OpenBabel__OBFreeGrid delete_OpenBabel__OBFreeGridPoint delete_OpenBabel__OBGenericData delete_OpenBabel__OBGlobalDataBase delete_OpenBabel__OBGraphSym delete_OpenBabel__OBGridData delete_OpenBabel__OBInternalCoord delete_OpenBabel__OBIsomorphismMapper delete_OpenBabel__OBMatrixData delete_OpenBabel__OBMessageHandler delete_OpenBabel__OBMinimizingEnergyConformerScore delete_OpenBabel__OBMinimizingRMSDConformerScore delete_OpenBabel__OBMol delete_OpenBabel__OBMolAngleIter delete_OpenBabel__OBMolAtomBFSIter delete_OpenBabel__OBMolAtomDFSIter delete_OpenBabel__OBMolAtomIter delete_OpenBabel__OBMolBondBFSIter delete_OpenBabel__OBMolBondIter delete_OpenBabel__OBMolPairIter delete_OpenBabel__OBMolRingIter delete_OpenBabel__OBMolTorsionIter delete_OpenBabel__OBOp delete_OpenBabel__OBOrbital delete_OpenBabel__OBOrbitalData delete_OpenBabel__OBPairData delete_OpenBabel__OBPcharge delete_OpenBabel__OBPlugin delete_OpenBabel__OBQuery delete_OpenBabel__OBQueryAtom delete_OpenBabel__OBQueryBond delete_OpenBabel__OBRMSDConformerScore delete_OpenBabel__OBRTree delete_OpenBabel__OBReaction delete_OpenBabel__OBResidue delete_OpenBabel__OBResidueAtomIter delete_OpenBabel__OBResidueData delete_OpenBabel__OBResidueIter delete_OpenBabel__OBRing delete_OpenBabel__OBRingData delete_OpenBabel__OBRingSearch delete_OpenBabel__OBRingTyper delete_OpenBabel__OBRotamerList delete_OpenBabel__OBRotationData delete_OpenBabel__OBRotor delete_OpenBabel__OBRotorKeys delete_OpenBabel__OBRotorList delete_OpenBabel__OBRotorRule delete_OpenBabel__OBRotorRules delete_OpenBabel__OBSSMatch delete_OpenBabel__OBSerialNums delete_OpenBabel__OBSetData delete_OpenBabel__OBSmartsMatcher delete_OpenBabel__OBSmartsPattern delete_OpenBabel__OBSpectrophore delete_OpenBabel__OBSqrtTbl delete_OpenBabel__OBSquarePlanarConfig delete_OpenBabel__OBSquarePlanarStereo delete_OpenBabel__OBStereo delete_OpenBabel__OBStereoBase delete_OpenBabel__OBStereoFacade delete_OpenBabel__OBStereoUnit delete_OpenBabel__OBStericConformerFilter delete_OpenBabel__OBStopwatch delete_OpenBabel__OBSymmetryData delete_OpenBabel__OBTetraNonPlanarStereo delete_OpenBabel__OBTetraPlanarStereo delete_OpenBabel__OBTetrahedralConfig delete_OpenBabel__OBTetrahedralStereo delete_OpenBabel__OBTorsion delete_OpenBabel__OBTorsionData delete_OpenBabel__OBTypeTable delete_OpenBabel__OBUnitCell delete_OpenBabel__OBVectorData delete_OpenBabel__OBVibrationData delete_OpenBabel__OBVirtualBond delete_OpenBabel__SpaceGroup delete_OpenBabel__matrix3x3 delete_OpenBabel__obLogBuf delete_OpenBabel__rotor_digit delete_OpenBabel__transform3d delete_OpenBabel__vector3 delete_std__basic_iosT_char_std__char_traitsT_char_t_t delete_std__basic_iostreamT_char_std__char_traitsT_char_t_t delete_std__basic_istreamT_char_std__char_traitsT_char_t_t delete_std__basic_ostreamT_char_std__char_traitsT_char_t_t delete_std__binary_functionT_char_const_p_char_const_p_bool_t delete_std__ios_base delete_std__pairT_unsigned_int_unsigned_int_t delete_std__stringbuf delete_std__vectorT_OpenBabel__OBBond_std__allocatorT_OpenBabel__OBBond_t_t delete_std__vectorT_OpenBabel__OBGenericData_p_std__allocatorT_OpenBabel__OBGenericData_p_t_t delete_std__vectorT_OpenBabel__OBInternalCoord_p_std__allocatorT_OpenBabel__OBInternalCoord_p_t_t delete_std__vectorT_OpenBabel__OBMol_std__allocatorT_OpenBabel__OBMol_t_t delete_std__vectorT_OpenBabel__OBResidue_std__allocatorT_OpenBabel__OBResidue_t_t delete_std__vectorT_OpenBabel__OBRing_p_std__allocatorT_OpenBabel__OBRing_p_t_t delete_std__vectorT_OpenBabel__OBRing_std__allocatorT_OpenBabel__OBRing_t_t delete_std__vectorT_OpenBabel__vector3_std__allocatorT_OpenBabel__vector3_t_t delete_std__vectorT_double_std__allocatorT_double_t_t delete_std__vectorT_int_std__allocatorT_int_t_t delete_std__vectorT_std__pairT_unsigned_int_unsigned_int_t_std__allocatorT_std__pairT_unsigned_int_unsigned_int_t_t_t delete_std__vectorT_std__string_std__allocatorT_std__string_t_t delete_std__vectorT_std__vectorT_OpenBabel__vector3_std__allocatorT_OpenBabel__vector3_t_t_std__allocatorT_std__vectorT_OpenBabel__vector3_std__allocatorT_OpenBabel__vector3_t_t_t_t delete_std__vectorT_std__vectorT_int_std__allocatorT_int_t_t_std__allocatorT_std__vectorT_int_std__allocatorT_int_t_t_t_t delete_std__vectorT_std__vectorT_std__pairT_unsigned_int_unsigned_int_t_std__allocatorT_std__pairT_unsigned_int_unsigned_int_t_t_t_std__allocatorT_std__vectorT_std__pairT_unsigned_int_unsigned_int_t_std__allocatorT_std__pairT_unsigned_int_unsigned_int_t_t_t_t_t delete_std__vectorT_unsigned_int_std__allocatorT_unsigned_int_t_t * checking Rd files ... NOTE prepare_Rd: canonicalNumbering_OB.Rd:30-32: Dropping empty section \note prepare_Rd: forEachMol.Rd:48-50: Dropping empty section \seealso * checking Rd metadata ... OK * checking Rd cross-references ... OK * checking for missing documentation entries ... WARNING Undocumented S4 methods: generic '$' and siglist '_p_OpenBabel__OBAlign' generic '$' and siglist '_p_OpenBabel__OBAtomHOF' generic '$' and siglist '_p_OpenBabel__OBAtomicHeatOfFormationTable' generic '$' and siglist '_p_OpenBabel__OBChargeModel' generic '$' and siglist '_p_OpenBabel__OBCisTransConfig' generic '$' and siglist '_p_OpenBabel__OBCisTransStereo' generic '$' and siglist '_p_OpenBabel__OBConformerFilter' generic '$' and siglist '_p_OpenBabel__OBConformerScore' generic '$' and siglist '_p_OpenBabel__OBConformerSearch' generic '$' and siglist '_p_OpenBabel__OBEnergyConformerScore' generic '$' and siglist '_p_OpenBabel__OBFreeGrid' generic '$' and siglist '_p_OpenBabel__OBFreeGridPoint' generic '$' and siglist '_p_OpenBabel__OBGraphSym' generic '$' and siglist '_p_OpenBabel__OBIsomorphismMapper' generic '$' and siglist '_p_OpenBabel__OBMinimizingEnergyConformerScore' generic '$' and siglist '_p_OpenBabel__OBPcharge' generic '$' and siglist '_p_OpenBabel__OBQuery' generic '$' and siglist '_p_OpenBabel__OBQueryAtom' generic '$' and siglist '_p_OpenBabel__OBQueryBond' generic '$' and siglist '_p_OpenBabel__OBReaction' generic '$' and siglist '_p_OpenBabel__OBRotamerList' generic '$' and siglist '_p_OpenBabel__OBRotor' generic '$' and siglist '_p_OpenBabel__OBRotorKeys' generic '$' and siglist '_p_OpenBabel__OBRotorList' generic '$' and siglist '_p_OpenBabel__OBRotorRule' generic '$' and siglist '_p_OpenBabel__OBRotorRules' generic '$' and siglist '_p_OpenBabel__OBSpectrophore' generic '$' and siglist '_p_OpenBabel__OBSquarePlanarConfig' generic '$' and siglist '_p_OpenBabel__OBSquarePlanarStereo' generic '$' and siglist '_p_OpenBabel__OBStereoBase' generic '$' and siglist '_p_OpenBabel__OBStereoFacade' generic '$' and siglist '_p_OpenBabel__OBStereoUnit' generic '$' and siglist '_p_OpenBabel__OBTetrahedralConfig' generic '$' and siglist '_p_OpenBabel__OBTetrahedralStereo' generic '$' and siglist '_p_OpenBabel__rotor_digit' generic '$' and siglist '_p_std__basic_iosT_char_std__char_traitsT_char_t_t' generic '$' and siglist '_p_std__basic_istreamT_char_std__char_traitsT_char_t_t' generic '$' and siglist '_p_std__basic_ostreamT_char_std__char_traitsT_char_t_t' generic '$' and siglist '_p_std__ios_base' generic '$<-' and siglist '_p_OpenBabel__OBCisTransConfig' generic '$<-' and siglist '_p_OpenBabel__OBSquarePlanarConfig' generic '$<-' and siglist '_p_OpenBabel__OBStereoUnit' generic '$<-' and siglist '_p_OpenBabel__OBTetrahedralConfig' generic '[[<-' and siglist '_p_OpenBabel__OBCisTransConfig,character' generic '[[<-' and siglist '_p_OpenBabel__OBSquarePlanarConfig,character' generic '[[<-' and siglist '_p_OpenBabel__OBStereoUnit,character' generic '[[<-' and siglist '_p_OpenBabel__OBTetrahedralConfig,character' All user-level objects in a package (including S4 classes and methods) should have documentation entries. See chapter ‘Writing R documentation files’ in the ‘Writing R Extensions’ manual. * checking for code/documentation mismatches ... OK * checking Rd \usage sections ... OK * checking Rd contents ... OK * checking for unstated dependencies in examples ... OK * checking line endings in shell scripts ... 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 is not available File ‘/Library/Frameworks/R.framework/Versions/4.4-x86_64/Resources/library/ChemmineOB/libs/ChemmineOB.so’: Found ‘__ZNSt3__14cerrE’, possibly from ‘std::cerr’ (C++) Found ‘__ZNSt3__14coutE’, possibly from ‘std::cout’ (C++) Found ‘_abort’, possibly from ‘abort’ (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 nor [v]sprintf. 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 ... OK * checking for unstated dependencies in ‘tests’ ... OK * checking tests ... Running ‘runTests.R’ OK * checking for unstated dependencies in vignettes ... OK * checking package vignettes ... OK * checking running R code from vignettes ... SKIPPED * checking re-building of vignette outputs ... SKIPPED * checking PDF version of manual ... OK * DONE Status: 2 WARNINGs, 7 NOTEs See ‘/Users/biocbuild/bbs-3.20-bioc/meat/ChemmineOB.Rcheck/00check.log’ for details.
ChemmineOB.Rcheck/00install.out
############################################################################## ############################################################################## ### ### Running command: ### ### /Library/Frameworks/R.framework/Resources/bin/R CMD INSTALL ChemmineOB ### ############################################################################## ############################################################################## * installing to library ‘/Library/Frameworks/R.framework/Versions/4.4-x86_64/Resources/library’ * installing *source* package ‘ChemmineOB’ ... ** using staged installation checking for pkg-config... /opt/R/x86_64/bin/pkg-config checking pkg-config is at least version 0.9.0... yes checking for OPENBABEL... no checking for OPENBABEL... no checking for gcc... clang -arch x86_64 checking whether the C compiler works... yes checking for C compiler default output file name... a.out checking for suffix of executables... checking whether we are cross compiling... no checking for suffix of object files... o checking whether we are using the GNU C compiler... yes checking whether clang -arch x86_64 accepts -g... yes checking for clang -arch x86_64 option to accept ISO C89... none needed checking how to run the C preprocessor... clang -arch x86_64 -E configure: creating ./config.status config.status: creating src/Makevars ** libs using C++ compiler: ‘Apple clang version 14.0.0 (clang-1400.0.29.202)’ using SDK: ‘MacOSX11.3.sdk’ clang++ -arch x86_64 -std=gnu++17 -I"/Library/Frameworks/R.framework/Resources/include" -DNDEBUG -I/usr/include/openbabel3 -I/usr/include/eigen3 -DUSE_BOOST -DHAVE_EIGEN -I/usr/local/include/eigen3 -I/usr/local/include/openbabel3 -I'/Library/Frameworks/R.framework/Versions/4.4-x86_64/Resources/library/BH/include' -I'/Library/Frameworks/R.framework/Versions/4.4-x86_64/Resources/library/Rcpp/include' -I'/Library/Frameworks/R.framework/Versions/4.4-x86_64/Resources/library/zlibbioc/include' -I/opt/R/x86_64/include -fPIC -falign-functions=64 -Wall -g -O2 -c ChemmineOB.cpp -o ChemmineOB.o In file included from ChemmineOB.cpp:1576: /usr/local/include/openbabel3/openbabel/griddata.h:74:12: warning: 'OpenBabel::OBGridData::GetValue' hides overloaded virtual function [-Woverloaded-virtual] double GetValue(int i, int j, int k) const; ^ /usr/local/include/openbabel3/openbabel/base.h:228:32: note: hidden overloaded virtual function 'OpenBabel::OBGenericData::GetValue' declared here: different number of parameters (0 vs 3) virtual const std::string &GetValue() const ^ In file included from ChemmineOB.cpp:1576: /usr/local/include/openbabel3/openbabel/griddata.h:76:12: warning: 'OpenBabel::OBGridData::GetValue' hides overloaded virtual function [-Woverloaded-virtual] double GetValue (vector3 pos) const; ^ /usr/local/include/openbabel3/openbabel/base.h:228:32: note: hidden overloaded virtual function 'OpenBabel::OBGenericData::GetValue' declared here: different number of parameters (0 vs 1) virtual const std::string &GetValue() const ^ In file included from ChemmineOB.cpp:1582: /usr/local/include/openbabel3/openbabel/reaction.h:99:15: warning: 'OpenBabel::OBReaction::GetTitle' hides overloaded virtual function [-Woverloaded-virtual] std::string GetTitle() const { return _title; } ^ /usr/local/include/openbabel3/openbabel/base.h:286:28: note: hidden overloaded virtual function 'OpenBabel::OBBase::GetTitle' declared here: different number of parameters (1 vs 0) virtual const char *GetTitle(bool UNUSED(replaceNewlines) = true) const { return "";} ^ In file included from ChemmineOB.cpp:1582: /usr/local/include/openbabel3/openbabel/reaction.h:101:8: warning: 'OpenBabel::OBReaction::SetTitle' hides overloaded virtual function [-Woverloaded-virtual] void SetTitle(const std::string& title) { _title=title; } ^ /usr/local/include/openbabel3/openbabel/base.h:287:21: note: hidden overloaded virtual function 'OpenBabel::OBBase::SetTitle' declared here: type mismatch at 1st parameter ('const char *' vs 'const std::string &' (aka 'const basic_string<char, char_traits<char>, allocator<char>> &')) virtual void SetTitle(const char *) {} ^ ChemmineOB.cpp:4160:7: warning: unused variable 'ecode' [-Wunused-variable] int ecode = 0; arg1 = (std::ios_base::event) swigarg_arg1; arg2 = (std::ios_base *) &swigarg_arg2; arg3 = (int) swigarg_arg3; ^ 5 warnings generated. clang++ -arch x86_64 -std=gnu++17 -I"/Library/Frameworks/R.framework/Resources/include" -DNDEBUG -I/usr/include/openbabel3 -I/usr/include/eigen3 -DUSE_BOOST -DHAVE_EIGEN -I/usr/local/include/eigen3 -I/usr/local/include/openbabel3 -I'/Library/Frameworks/R.framework/Versions/4.4-x86_64/Resources/library/BH/include' -I'/Library/Frameworks/R.framework/Versions/4.4-x86_64/Resources/library/Rcpp/include' -I'/Library/Frameworks/R.framework/Versions/4.4-x86_64/Resources/library/zlibbioc/include' -I/opt/R/x86_64/include -fPIC -falign-functions=64 -Wall -g -O2 -c canonical.cpp -o canonical.o clang++ -arch x86_64 -std=gnu++17 -dynamiclib -Wl,-headerpad_max_install_names -undefined dynamic_lookup -L/Library/Frameworks/R.framework/Resources/lib -L/opt/R/x86_64/lib -o ChemmineOB.so ChemmineOB.o canonical.o -L/usr/local/lib/openbabel3 -lopenbabel -F/Library/Frameworks/R.framework/.. -framework R -Wl,-framework -Wl,CoreFoundation ld: warning: dylib (/usr/local/lib/openbabel3/libopenbabel.dylib) was built for newer macOS version (12.0) than being linked (11.0) installing to /Library/Frameworks/R.framework/Versions/4.4-x86_64/Resources/library/00LOCK-ChemmineOB/00new/ChemmineOB/libs ** R ** inst ** byte-compile and prepare package for lazy loading in method for ‘copyToR’ with signature ‘"_p_std::char_traits<(char)>"’: no definition for class “_p_std::char_traits<(char)>” in method for ‘copyToR’ with signature ‘"_p_std::pair<(unsigned int,unsigned int)>"’: no definition for class “_p_std::pair<(unsigned int,unsigned int)>” in method for ‘copyToR’ with signature ‘"_p_OpenBabel::CharPtrLess"’: no definition for class “_p_OpenBabel::CharPtrLess” in method for ‘copyToR’ with signature ‘"_p_OpenBabel::FptIndexHeader"’: no definition for class “_p_OpenBabel::FptIndexHeader” in method for ‘copyToR’ with signature ‘"_p_OpenBabel::OBStereo"’: no definition for class “_p_OpenBabel::OBStereo” in method for ‘copyToR’ with signature ‘"_p_OpenBabel::OBStereoUnit"’: no definition for class “_p_OpenBabel::OBStereoUnit” in method for ‘copyToR’ with signature ‘"_p_OpenBabel::LineSearchType"’: no definition for class “_p_OpenBabel::LineSearchType” in method for ‘copyToR’ with signature ‘"_p_OpenBabel::OBTetrahedralConfig"’: no definition for class “_p_OpenBabel::OBTetrahedralConfig” in method for ‘copyToR’ with signature ‘"_p_OpenBabel::OBCisTransConfig"’: no definition for class “_p_OpenBabel::OBCisTransConfig” in method for ‘copyToR’ with signature ‘"_p_OpenBabel::OBSquarePlanarConfig"’: no definition for class “_p_OpenBabel::OBSquarePlanarConfig” ** help *** installing help indices ** building package indices ** installing vignettes ** testing if installed package can be loaded from temporary location ** checking absolute paths in shared objects and dynamic libraries ** testing if installed package can be loaded from final location ** testing if installed package keeps a record of temporary installation path * DONE (ChemmineOB)
ChemmineOB.Rcheck/tests/runTests.Rout
R version 4.4.0 Patched (2024-04-24 r86482) -- "Puppy Cup" Copyright (C) 2024 The R Foundation for Statistical Computing Platform: x86_64-apple-darwin20 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. > if(ChemmineOB:::.supportedPlatform()){ + BiocGenerics:::testPackage("ChemmineOB") + }else{ + message("Not running tests on unsupported platform ", .Platform$OS, " ", .Platform$r_arch) + } [1] "test1\n OpenBabel06102401122D\n\n 7 6 0 0 1 0 0 0 0 0999 V2000\n 0.8660 -2.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0\n 0.8660 -1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 1.7321 -1.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0\n 0.0000 -1.0000 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0\n -1.0000 -1.0000 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0\n -0.5000 -1.8660 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0\n 0.0000 0.0000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0\n 1 2 1 0 0 0 0\n 2 3 2 0 0 0 0\n 2 4 1 0 0 0 0\n 4 5 1 0 0 0 0\n 4 6 1 0 0 0 0\n 4 7 1 0 0 0 0\nM END\n$$$$\n" [1] "OC(=O)C(Br)(Cl)N\ttest1\n" [1] "OC(=O)C(Br)(Cl)N\ttest1\n" [1] "labels:" [[1]] [1] 25 47 48 16 6 55 24 15 2 7 30 33 34 37 40 19 17 18 12 9 23 22 29 5 46 [26] 27 49 50 3 4 8 57 58 32 35 36 38 39 41 42 43 44 31 20 21 13 14 28 26 10 [51] 11 45 51 52 53 54 1 56 59 60 61 650001 mass: 456.200884636001 ============================== *** Open Babel Warning in ParseSmiles Failed to kekulize aromatic SMILES 2024-06-10 01:13:02.298 R[58051:471568779] XType: com.apple.fonts is not accessible. 2024-06-10 01:13:02.298 R[58051:471568779] XType: XTFontStaticRegistry is enabled. start of smartsOB ============================== *** Open Babel Warning in ParseSmiles Failed to kekulize aromatic SMILES before smartsSearch_OB rotable bonds: CMP1 CMP2 CMP3 CMP4 CMP5 24 20 14 30 10 sdfid: [1] "650001" "650002" "650003" "650004" "650005" checking equals... RUNIT TEST PROTOCOL -- Mon Jun 10 01:13:03 2024 *********************************************** Number of test functions: 9 Number of errors: 0 Number of failures: 0 1 Test Suite : ChemmineOB RUnit Tests - 9 test functions, 0 errors, 0 failures Number of test functions: 9 Number of errors: 0 Number of failures: 0 > > proc.time() user system elapsed 6.412 0.551 7.511
ChemmineOB.Rcheck/ChemmineOB-Ex.timings
name | user | system | elapsed | |
canonicalNumbering_OB | 0.000 | 0.001 | 0.001 | |
convertFormat | 0.000 | 0.000 | 0.001 | |
convertFormatFile | 0.000 | 0.000 | 0.001 | |
convertToImage | 0.001 | 0.001 | 0.001 | |
exactMass_OB | 0.001 | 0.000 | 0.001 | |
fingerprint_OB | 0 | 0 | 0 | |
forEachMol | 0 | 0 | 0 | |
prop_OB | 0.000 | 0.000 | 0.001 | |
smartsSearch_OB | 0 | 0 | 0 | |