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This page was generated on 2017-10-18 14:27:07 -0400 (Wed, 18 Oct 2017).
Package 127/1381 | Hostname | OS / Arch | INSTALL | BUILD | CHECK | BUILD BIN | ||||||
BioMedR 1.0.0 Min-feng Zhu
| malbec2 | Linux (Ubuntu 16.04.1 LTS) / x86_64 | NotNeeded | OK | ERROR | |||||||
tokay2 | Windows Server 2012 R2 Standard / x64 | NotNeeded | OK | [ ERROR ] | OK | |||||||
veracruz2 | OS X 10.11.6 El Capitan / x86_64 | NotNeeded | OK | ERROR | OK |
Package: BioMedR |
Version: 1.0.0 |
Command: rm -rf BioMedR.buildbin-libdir BioMedR.Rcheck && mkdir BioMedR.buildbin-libdir BioMedR.Rcheck && C:\Users\biocbuild\bbs-3.5-bioc\R\bin\R.exe CMD INSTALL --build --merge-multiarch --library=BioMedR.buildbin-libdir BioMedR_1.0.0.tar.gz >BioMedR.Rcheck\00install.out 2>&1 && cp BioMedR.Rcheck\00install.out BioMedR-install.out && C:\Users\biocbuild\bbs-3.5-bioc\R\bin\R.exe CMD check --library=BioMedR.buildbin-libdir --install="check:BioMedR-install.out" --force-multiarch --no-vignettes --timings BioMedR_1.0.0.tar.gz |
StartedAt: 2017-10-17 22:20:50 -0400 (Tue, 17 Oct 2017) |
EndedAt: 2017-10-17 22:26:45 -0400 (Tue, 17 Oct 2017) |
EllapsedTime: 354.9 seconds |
RetCode: 1 |
Status: ERROR |
CheckDir: BioMedR.Rcheck |
Warnings: NA |
############################################################################## ############################################################################## ### ### Running command: ### ### rm -rf BioMedR.buildbin-libdir BioMedR.Rcheck && mkdir BioMedR.buildbin-libdir BioMedR.Rcheck && C:\Users\biocbuild\bbs-3.5-bioc\R\bin\R.exe CMD INSTALL --build --merge-multiarch --library=BioMedR.buildbin-libdir BioMedR_1.0.0.tar.gz >BioMedR.Rcheck\00install.out 2>&1 && cp BioMedR.Rcheck\00install.out BioMedR-install.out && C:\Users\biocbuild\bbs-3.5-bioc\R\bin\R.exe CMD check --library=BioMedR.buildbin-libdir --install="check:BioMedR-install.out" --force-multiarch --no-vignettes --timings BioMedR_1.0.0.tar.gz ### ############################################################################## ############################################################################## * using log directory 'C:/Users/biocbuild/bbs-3.5-bioc/meat/BioMedR.Rcheck' * using R version 3.4.2 Patched (2017-10-07 r73498) * using platform: x86_64-w64-mingw32 (64-bit) * using session charset: ISO8859-1 * using option '--no-vignettes' * checking for file 'BioMedR/DESCRIPTION' ... OK * checking extension type ... Package * this is package 'BioMedR' version '1.0.0' * 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 whether package 'BioMedR' 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 ** checking loading without being on the library search path ... 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 loading without being on the library search path ... OK * checking dependencies in R code ... OK * 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 installed files from 'inst/doc' ... OK * checking files in 'vignettes' ... OK * checking examples ... ** running examples for arch 'i386' ... OK Examples with CPU or elapsed time > 5s user system elapsed parSeqSim 0.72 0.05 12.72 calcParProtSeqSim 0.25 0.02 5.89 ** running examples for arch 'x64' ... OK Examples with CPU or elapsed time > 5s user system elapsed extrDrugKR 7.92 0.16 1.29 extrDrugMannholdLogP 6.12 0.09 3.26 parSeqSim 0.68 0.03 14.31 calcParProtSeqSim 0.29 0.00 9.19 * checking for unstated dependencies in 'tests' ... OK * checking tests ... ** running tests for arch 'i386' ... Running 'runTests.R' Warning message: running command '"C:/Users/BIOCBU˜1/BBS-3˜1.5-B/R/bin/i386/R" CMD BATCH --vanilla "runTests.R" "runTests.Rout"' had status 1 ERROR Running the tests in 'tests/runTests.R' failed. Last 13 lines of output: 1 Test Suite : BioMedR RUnit Tests - 7 test functions, 0 errors, 1 failure FAILURE in test_extrDrugALOGP: Error in checkEqualsNumeric(sum(as.matrix(dat)), 328.1937635, tolerance = 1e-04) : Mean relative difference: 0.04145779 Test files with failing tests test_extractDrugALOGP.R test_extrDrugALOGP Error in BiocGenerics:::testPackage("BioMedR") : unit tests failed for package BioMedR Execution halted ** running tests for arch 'x64' ... Running 'runTests.R' Warning message: running command '"C:/Users/BIOCBU˜1/BBS-3˜1.5-B/R/bin/x64/R" CMD BATCH --vanilla "runTests.R" "runTests.Rout"' had status 1 ERROR Running the tests in 'tests/runTests.R' failed. Last 13 lines of output: 1 Test Suite : BioMedR RUnit Tests - 7 test functions, 0 errors, 1 failure FAILURE in test_extrDrugALOGP: Error in checkEqualsNumeric(sum(as.matrix(dat)), 328.1937635, tolerance = 1e-04) : Mean relative difference: 0.04145779 Test files with failing tests test_extractDrugALOGP.R test_extrDrugALOGP Error in BiocGenerics:::testPackage("BioMedR") : unit tests failed for package BioMedR Execution halted * 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 ERRORs See 'C:/Users/biocbuild/bbs-3.5-bioc/meat/BioMedR.Rcheck/00check.log' for details.
runTests.Rout.fail:
R version 3.4.2 Patched (2017-10-07 r73498) -- "Short Summer" Copyright (C) 2017 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. > BiocGenerics:::testPackage('BioMedR') Timing stopped at: 0.51 0.03 0.45 Error in checkEqualsNumeric(sum(as.matrix(dat)), 328.1937635, tolerance = 1e-04) : Mean relative difference: 0.04145779 RUNIT TEST PROTOCOL -- Tue Oct 17 22:26:21 2017 *********************************************** Number of test functions: 7 Number of errors: 0 Number of failures: 1 1 Test Suite : BioMedR RUnit Tests - 7 test functions, 0 errors, 1 failure FAILURE in test_extrDrugALOGP: Error in checkEqualsNumeric(sum(as.matrix(dat)), 328.1937635, tolerance = 1e-04) : Mean relative difference: 0.04145779 Test files with failing tests test_extractDrugALOGP.R test_extrDrugALOGP Error in BiocGenerics:::testPackage("BioMedR") : unit tests failed for package BioMedR Execution halted
runTests.Rout.fail:
R version 3.4.2 Patched (2017-10-07 r73498) -- "Short Summer" Copyright (C) 2017 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. > BiocGenerics:::testPackage('BioMedR') Timing stopped at: 1.24 0.12 0.63 Error in checkEqualsNumeric(sum(as.matrix(dat)), 328.1937635, tolerance = 1e-04) : Mean relative difference: 0.04145779 RUNIT TEST PROTOCOL -- Tue Oct 17 22:26:31 2017 *********************************************** Number of test functions: 7 Number of errors: 0 Number of failures: 1 1 Test Suite : BioMedR RUnit Tests - 7 test functions, 0 errors, 1 failure FAILURE in test_extrDrugALOGP: Error in checkEqualsNumeric(sum(as.matrix(dat)), 328.1937635, tolerance = 1e-04) : Mean relative difference: 0.04145779 Test files with failing tests test_extractDrugALOGP.R test_extrDrugALOGP Error in BiocGenerics:::testPackage("BioMedR") : unit tests failed for package BioMedR Execution halted
BioMedR.Rcheck/00install.out:
install for i386 * installing *source* package 'BioMedR' ... ** R ** data *** moving datasets to lazyload DB ** inst ** preparing package for lazy loading ** help *** installing help indices ** building package indices ** installing vignettes ** testing if installed package can be loaded install for x64 * installing *source* package 'BioMedR' ... ** testing if installed package can be loaded * MD5 sums packaged installation of 'BioMedR' as BioMedR_1.0.0.zip * DONE (BioMedR)
BioMedR.Rcheck/examples_i386/BioMedR-Ex.timings:
name | user | system | elapsed | |
AA2DACOR | 0.03 | 0.00 | 0.03 | |
AA3DMoRSE | 0 | 0 | 0 | |
AAACF | 0 | 0 | 0 | |
AABLOSUM100 | 0.00 | 0.02 | 0.02 | |
AABLOSUM45 | 0 | 0 | 0 | |
AABLOSUM50 | 0 | 0 | 0 | |
AABLOSUM62 | 0.02 | 0.00 | 0.01 | |
AABLOSUM80 | 0 | 0 | 0 | |
AABurden | 0 | 0 | 0 | |
AACPSA | 0 | 0 | 0 | |
AAConn | 0 | 0 | 0 | |
AAConst | 0 | 0 | 0 | |
AADescAll | 0 | 0 | 0 | |
AAEdgeAdj | 0 | 0 | 0 | |
AAEigIdx | 0 | 0 | 0 | |
AAFGC | 0 | 0 | 0 | |
AAGETAWAY | 0 | 0 | 0 | |
AAGeom | 0 | 0 | 0 | |
AAInfo | 0.02 | 0.00 | 0.02 | |
AAMOE2D | 0 | 0 | 0 | |
AAMOE3D | 0.00 | 0.02 | 0.01 | |
AAMetaInfo | 0 | 0 | 0 | |
AAMolProp | 0 | 0 | 0 | |
AAPAM120 | 0 | 0 | 0 | |
AAPAM250 | 0 | 0 | 0 | |
AAPAM30 | 0 | 0 | 0 | |
AAPAM40 | 0 | 0 | 0 | |
AAPAM70 | 0.00 | 0.01 | 0.02 | |
AARDF | 0 | 0 | 0 | |
AARandic | 0.00 | 0.02 | 0.02 | |
AATopo | 0 | 0 | 0 | |
AATopoChg | 0.00 | 0.01 | 0.01 | |
AAWHIM | 0 | 0 | 0 | |
AAWalk | 0.01 | 0.00 | 0.02 | |
AAindex | 0 | 0 | 0 | |
Autocorrelation | 1.03 | 0.14 | 4.25 | |
BMgetDNAGenBank | 0 | 0 | 0 | |
BioMedR-package | 0 | 0 | 0 | |
Constitutional | 0.49 | 0.00 | 1.07 | |
NNeighbors | 1.11 | 0.00 | 1.11 | |
OptAA3d | 0 | 0 | 0 | |
acc | 0 | 0 | 0 | |
apfp | 0 | 0 | 0 | |
atomprop | 0 | 0 | 0 | |
bcl | 0 | 0 | 0 | |
calcDrugFPSim | 0 | 0 | 0 | |
calcDrugMCSSim | 0.58 | 0.03 | 1.70 | |
calcParProtGOSim | 0 | 0 | 0 | |
calcParProtSeqSim | 0.25 | 0.02 | 5.89 | |
calcTwoProtGOSim | 0 | 0 | 0 | |
calcTwoProtSeqSim | 0.16 | 0.00 | 0.16 | |
checkDNA | 0 | 0 | 0 | |
checkProt | 0 | 0 | 0 | |
clusterCMP | 1.54 | 0.03 | 1.56 | |
clusterJP | 1.95 | 0.00 | 1.96 | |
clusterMDS | 0.53 | 0.00 | 0.53 | |
clusterStat | 0.27 | 0.00 | 0.26 | |
connectivity | 1.70 | 0.01 | 1.77 | |
convAPtoFP | 0.37 | 0.00 | 0.37 | |
convSDFtoAP | 0.07 | 0.00 | 0.07 | |
extrDNADAC | 0.01 | 0.00 | 0.01 | |
extrDNADACC | 0.08 | 0.00 | 0.08 | |
extrDNADCC | 0.09 | 0.00 | 0.09 | |
extrDNAIncDiv | 0.1 | 0.0 | 0.1 | |
extrDNAPseDNC | 0 | 0 | 0 | |
extrDNAPseKNC | 0.01 | 0.00 | 0.01 | |
extrDNATAC | 0 | 0 | 0 | |
extrDNATACC | 0.06 | 0.00 | 0.06 | |
extrDNATCC | 0.09 | 0.00 | 0.10 | |
extrDNAkmer | 0 | 0 | 0 | |
extrDrugAIO | 0 | 0 | 0 | |
extrDrugAP | 0.2 | 0.0 | 0.2 | |
extrDrugBCUT | 0.08 | 0.00 | 0.14 | |
extrDrugCPSA | 0.30 | 0.05 | 0.94 | |
extrDrugEstate | 0.31 | 0.00 | 0.47 | |
extrDrugEstateComplete | 0.06 | 0.00 | 0.05 | |
extrDrugExtended | 0.06 | 0.00 | 0.13 | |
extrDrugExtendedComplete | 0.03 | 0.00 | 0.01 | |
extrDrugGraph | 0.03 | 0.00 | 0.05 | |
extrDrugGraphComplete | 0.02 | 0.00 | 0.02 | |
extrDrugHybridization | 0.02 | 0.00 | 0.01 | |
extrDrugHybridizationComplete | 0.03 | 0.00 | 0.02 | |
extrDrugHybridizationRatio | 0.03 | 0.00 | 0.03 | |
extrDrugIPMolecularLearning | 0.00 | 0.00 | 0.04 | |
extrDrugKR | 2.39 | 0.00 | 2.25 | |
extrDrugKRComplete | 2.05 | 0.01 | 2.06 | |
extrDrugKappaShapeIndices | 0.08 | 0.02 | 0.14 | |
extrDrugKierHallSmarts | 0.08 | 0.00 | 0.11 | |
extrDrugMACCS | 0.13 | 0.00 | 0.12 | |
extrDrugMACCSComplete | 0.06 | 0.00 | 0.07 | |
extrDrugMannholdLogP | 3.02 | 0.01 | 2.95 | |
extrDrugOBFP2 | 0.17 | 0.00 | 0.41 | |
extrDrugOBFP3 | 0 | 0 | 0 | |
extrDrugOBFP4 | 0.11 | 0.00 | 0.12 | |
extrDrugPubChem | 0.44 | 0.02 | 0.43 | |
extrDrugPubChemComplete | 0.39 | 0.00 | 0.40 | |
extrDrugShortestPath | 0 | 0 | 0 | |
extrDrugShortestPathComplete | 0 | 0 | 0 | |
extrDrugStandard | 0.02 | 0.00 | 0.01 | |
extrDrugStandardComplete | 0.01 | 0.00 | 0.02 | |
extrDrugWHIM | 0.11 | 0.00 | 0.11 | |
extrPCMBLOSUM | 0.08 | 0.00 | 0.10 | |
extrPCMDescScales | 0.01 | 0.00 | 0.01 | |
extrPCMFAScales | 0.05 | 0.00 | 0.05 | |
extrPCMMDSScales | 0.01 | 0.00 | 0.01 | |
extrPCMPropScales | 0.05 | 0.00 | 0.05 | |
extrPCMScaleGap | 0.03 | 0.00 | 0.03 | |
extrPCMScales | 0.05 | 0.00 | 0.05 | |
extrProtAAC | 0 | 0 | 0 | |
extrProtAPAAC | 1.23 | 0.00 | 1.23 | |
extrProtCTDC | 0.02 | 0.00 | 0.02 | |
extrProtCTDCClass | 0 | 0 | 0 | |
extrProtCTDD | 0 | 0 | 0 | |
extrProtCTDDClass | 0.01 | 0.00 | 0.01 | |
extrProtCTDT | 0 | 0 | 0 | |
extrProtCTDTClass | 0.00 | 0.01 | 0.02 | |
extrProtCTriad | 0.10 | 0.02 | 0.11 | |
extrProtCTriadClass | 0.09 | 0.00 | 0.09 | |
extrProtDC | 0 | 0 | 0 | |
extrProtFPGap | 0.03 | 0.00 | 0.03 | |
extrProtGeary | 0.14 | 0.02 | 0.16 | |
extrProtMoran | 0.14 | 0.00 | 0.14 | |
extrProtMoreauBroto | 0.14 | 0.00 | 0.14 | |
extrProtPAAC | 0.40 | 0.00 | 0.39 | |
extrProtPSSM | 0 | 0 | 0 | |
extrProtPSSMAcc | 0 | 0 | 0 | |
extrProtPSSMFeature | 0 | 0 | 0 | |
extrProtQSO | 0.65 | 0.00 | 0.66 | |
extrProtSOCN | 0.64 | 0.00 | 0.64 | |
extrProtTC | 0.05 | 0.01 | 0.06 | |
geometric | 0.05 | 0.00 | 0.10 | |
getCPI | 0 | 0 | 0 | |
getDrug | 0 | 0 | 0 | |
getProt | 0 | 0 | 0 | |
make_kmer_index | 0 | 0 | 0 | |
parGOSim | 0 | 0 | 0 | |
parSeqSim | 0.72 | 0.05 | 12.72 | |
plotStructure | 0.36 | 0.01 | 0.37 | |
pls.cv | 0.26 | 0.00 | 0.27 | |
property | 0.24 | 0.02 | 0.40 | |
readFASTA | 0 | 0 | 0 | |
readMolFromSDF | 0.03 | 0.00 | 0.03 | |
readMolFromSmi | 0 | 0 | 0 | |
readPDB | 1.90 | 0.03 | 1.94 | |
revchars | 0 | 0 | 0 | |
rf.cv | 0.71 | 0.02 | 0.72 | |
rf.fs | 0.69 | 0.00 | 0.68 | |
sdfbcl | 0 | 0 | 0 | |
searchDrug | 0 | 0 | 0 | |
segProt | 0 | 0 | 0 | |
topology | 0.37 | 0.03 | 0.49 | |
twoGOSim | 0 | 0 | 0 | |
twoSeqSim | 0.57 | 0.03 | 0.59 | |
BioMedR.Rcheck/examples_x64/BioMedR-Ex.timings:
name | user | system | elapsed | |
AA2DACOR | 0.00 | 0.03 | 0.03 | |
AA3DMoRSE | 0 | 0 | 0 | |
AAACF | 0.02 | 0.00 | 0.01 | |
AABLOSUM100 | 0 | 0 | 0 | |
AABLOSUM45 | 0 | 0 | 0 | |
AABLOSUM50 | 0 | 0 | 0 | |
AABLOSUM62 | 0.02 | 0.00 | 0.02 | |
AABLOSUM80 | 0 | 0 | 0 | |
AABurden | 0.00 | 0.02 | 0.01 | |
AACPSA | 0 | 0 | 0 | |
AAConn | 0 | 0 | 0 | |
AAConst | 0.00 | 0.01 | 0.02 | |
AADescAll | 0 | 0 | 0 | |
AAEdgeAdj | 0.01 | 0.00 | 0.01 | |
AAEigIdx | 0 | 0 | 0 | |
AAFGC | 0 | 0 | 0 | |
AAGETAWAY | 0.00 | 0.02 | 0.02 | |
AAGeom | 0 | 0 | 0 | |
AAInfo | 0.02 | 0.00 | 0.01 | |
AAMOE2D | 0 | 0 | 0 | |
AAMOE3D | 0 | 0 | 0 | |
AAMetaInfo | 0.00 | 0.01 | 0.02 | |
AAMolProp | 0 | 0 | 0 | |
AAPAM120 | 0 | 0 | 0 | |
AAPAM250 | 0.01 | 0.00 | 0.02 | |
AAPAM30 | 0 | 0 | 0 | |
AAPAM40 | 0 | 0 | 0 | |
AAPAM70 | 0 | 0 | 0 | |
AARDF | 0 | 0 | 0 | |
AARandic | 0.00 | 0.02 | 0.02 | |
AATopo | 0 | 0 | 0 | |
AATopoChg | 0 | 0 | 0 | |
AAWHIM | 0 | 0 | 0 | |
AAWalk | 0.00 | 0.02 | 0.02 | |
AAindex | 0 | 0 | 0 | |
Autocorrelation | 1.94 | 0.17 | 1.03 | |
BMgetDNAGenBank | 0 | 0 | 0 | |
BioMedR-package | 0 | 0 | 0 | |
Constitutional | 0.72 | 0.01 | 0.44 | |
NNeighbors | 0.98 | 0.05 | 1.06 | |
OptAA3d | 0 | 0 | 0 | |
acc | 0 | 0 | 0 | |
apfp | 0.02 | 0.00 | 0.01 | |
atomprop | 0 | 0 | 0 | |
bcl | 0 | 0 | 0 | |
calcDrugFPSim | 0 | 0 | 0 | |
calcDrugMCSSim | 0.53 | 0.03 | 1.08 | |
calcParProtGOSim | 0 | 0 | 0 | |
calcParProtSeqSim | 0.29 | 0.00 | 9.19 | |
calcTwoProtGOSim | 0 | 0 | 0 | |
calcTwoProtSeqSim | 0.16 | 0.00 | 0.15 | |
checkDNA | 0 | 0 | 0 | |
checkProt | 0 | 0 | 0 | |
clusterCMP | 1.57 | 0.02 | 1.59 | |
clusterJP | 2.14 | 0.03 | 2.20 | |
clusterMDS | 0.61 | 0.00 | 0.66 | |
clusterStat | 0.46 | 0.00 | 0.45 | |
connectivity | 2.77 | 0.06 | 0.94 | |
convAPtoFP | 0.47 | 0.00 | 0.33 | |
convSDFtoAP | 0.04 | 0.00 | 0.04 | |
extrDNADAC | 0 | 0 | 0 | |
extrDNADACC | 0.09 | 0.00 | 0.09 | |
extrDNADCC | 0.11 | 0.00 | 0.11 | |
extrDNAIncDiv | 0.11 | 0.00 | 0.11 | |
extrDNAPseDNC | 0 | 0 | 0 | |
extrDNAPseKNC | 0.02 | 0.00 | 0.02 | |
extrDNATAC | 0.01 | 0.00 | 0.01 | |
extrDNATACC | 0.1 | 0.0 | 0.1 | |
extrDNATCC | 0.10 | 0.00 | 0.09 | |
extrDNAkmer | 0.00 | 0.02 | 0.02 | |
extrDrugAIO | 0 | 0 | 0 | |
extrDrugAP | 0.18 | 0.00 | 0.19 | |
extrDrugBCUT | 0.10 | 0.00 | 0.04 | |
extrDrugCPSA | 0.59 | 0.01 | 0.24 | |
extrDrugEstate | 0.59 | 0.05 | 0.36 | |
extrDrugEstateComplete | 0.33 | 0.00 | 0.05 | |
extrDrugExtended | 0.19 | 0.00 | 0.07 | |
extrDrugExtendedComplete | 0.06 | 0.00 | 0.03 | |
extrDrugGraph | 0.08 | 0.00 | 0.02 | |
extrDrugGraphComplete | 0.02 | 0.01 | 0.03 | |
extrDrugHybridization | 0.07 | 0.00 | 0.02 | |
extrDrugHybridizationComplete | 0.07 | 0.00 | 0.02 | |
extrDrugHybridizationRatio | 0.14 | 0.00 | 0.05 | |
extrDrugIPMolecularLearning | 0.05 | 0.00 | 0.02 | |
extrDrugKR | 7.92 | 0.16 | 1.29 | |
extrDrugKRComplete | 1.18 | 0.00 | 0.99 | |
extrDrugKappaShapeIndices | 0.10 | 0.00 | 0.09 | |
extrDrugKierHallSmarts | 0.09 | 0.00 | 0.08 | |
extrDrugMACCS | 0.99 | 0.00 | 0.11 | |
extrDrugMACCSComplete | 0.31 | 0.00 | 0.05 | |
extrDrugMannholdLogP | 6.12 | 0.09 | 3.26 | |
extrDrugOBFP2 | 0.16 | 0.00 | 0.31 | |
extrDrugOBFP3 | 0 | 0 | 0 | |
extrDrugOBFP4 | 0.09 | 0.00 | 0.09 | |
extrDrugPubChem | 1.41 | 0.05 | 0.25 | |
extrDrugPubChemComplete | 0.95 | 0.02 | 0.14 | |
extrDrugShortestPath | 0 | 0 | 0 | |
extrDrugShortestPathComplete | 0 | 0 | 0 | |
extrDrugStandard | 0 | 0 | 0 | |
extrDrugStandardComplete | 0.09 | 0.00 | 0.02 | |
extrDrugWHIM | 0.30 | 0.01 | 0.12 | |
extrPCMBLOSUM | 0.12 | 0.00 | 0.11 | |
extrPCMDescScales | 0.01 | 0.00 | 0.01 | |
extrPCMFAScales | 0.03 | 0.00 | 0.03 | |
extrPCMMDSScales | 0.02 | 0.00 | 0.02 | |
extrPCMPropScales | 0.06 | 0.00 | 0.06 | |
extrPCMScaleGap | 0.02 | 0.00 | 0.02 | |
extrPCMScales | 0.01 | 0.02 | 0.03 | |
extrProtAAC | 0 | 0 | 0 | |
extrProtAPAAC | 1.13 | 0.01 | 1.14 | |
extrProtCTDC | 0.00 | 0.02 | 0.01 | |
extrProtCTDCClass | 0 | 0 | 0 | |
extrProtCTDD | 0.01 | 0.00 | 0.02 | |
extrProtCTDDClass | 0 | 0 | 0 | |
extrProtCTDT | 0 | 0 | 0 | |
extrProtCTDTClass | 0 | 0 | 0 | |
extrProtCTriad | 0.19 | 0.00 | 0.19 | |
extrProtCTriadClass | 0.09 | 0.00 | 0.10 | |
extrProtDC | 0.02 | 0.00 | 0.01 | |
extrProtFPGap | 0.01 | 0.00 | 0.02 | |
extrProtGeary | 0.21 | 0.02 | 0.20 | |
extrProtMoran | 0.18 | 0.00 | 0.19 | |
extrProtMoreauBroto | 0.19 | 0.00 | 0.19 | |
extrProtPAAC | 0.66 | 0.00 | 0.65 | |
extrProtPSSM | 0 | 0 | 0 | |
extrProtPSSMAcc | 0 | 0 | 0 | |
extrProtPSSMFeature | 0 | 0 | 0 | |
extrProtQSO | 1.32 | 0.00 | 1.33 | |
extrProtSOCN | 0.96 | 0.00 | 0.95 | |
extrProtTC | 0.03 | 0.01 | 0.05 | |
geometric | 0.03 | 0.02 | 0.05 | |
getCPI | 0.02 | 0.00 | 0.01 | |
getDrug | 0 | 0 | 0 | |
getProt | 0 | 0 | 0 | |
make_kmer_index | 0 | 0 | 0 | |
parGOSim | 0 | 0 | 0 | |
parSeqSim | 0.68 | 0.03 | 14.31 | |
plotStructure | 0.42 | 0.00 | 0.42 | |
pls.cv | 0.38 | 0.00 | 0.38 | |
property | 0.48 | 0.03 | 0.22 | |
readFASTA | 0 | 0 | 0 | |
readMolFromSDF | 0.02 | 0.01 | 0.01 | |
readMolFromSmi | 0 | 0 | 0 | |
readPDB | 1.76 | 0.00 | 1.68 | |
revchars | 0 | 0 | 0 | |
rf.cv | 1.38 | 0.00 | 2.29 | |
rf.fs | 0.53 | 0.00 | 0.53 | |
sdfbcl | 0 | 0 | 0 | |
searchDrug | 0 | 0 | 0 | |
segProt | 0 | 0 | 0 | |
topology | 0.47 | 0.00 | 0.31 | |
twoGOSim | 0 | 0 | 0 | |
twoSeqSim | 0.83 | 0.02 | 0.84 | |