# HG changeset patch # User tomnl # Date 1528981690 14400 # Node ID afe116ad4a5b158b39be87403ed2136178c6bb2d # Parent 7bff866f72b500567e9cd3e74cf68d67d537a836 planemo upload for repository https://github.com/computational-metabolomics/mspurity-galaxy commit f79fa34772bbab836d89cf8bad52d49285409a98 diff -r 7bff866f72b5 -r afe116ad4a5b backup_sqlite.R --- a/backup_sqlite.R Mon Jun 11 07:49:38 2018 -0400 +++ /dev/null Thu Jan 01 00:00:00 1970 +0000 @@ -1,280 +0,0 @@ -library(msPurity) -library(optparse) -library(xcms) -library(CAMERA) -print(sessionInfo()) -print('CREATING DATABASE') - - -xset_pa_filename_fix <- function(opt, pa, xset){ - - - if (!is.null(opt$mzML_files) && !is.null(opt$galaxy_names)){ - # NOTE: Relies on the pa@fileList having the names of files given as 'names' of the variables - # needs to be done due to Galaxy moving the files around and screwing up any links to files - - filepaths <- trimws(strsplit(opt$mzML_files, ',')[[1]]) - filepaths <- filepaths[filepaths != ""] - new_names <- basename(filepaths) - - galaxy_names <- trimws(strsplit(opt$galaxy_names, ',')[[1]]) - galaxy_names <- galaxy_names[galaxy_names != ""] - - nsave <- names(pa@fileList) - old_filenames <- basename(pa@fileList) - pa@fileList <- filepaths[match(names(pa@fileList), galaxy_names)] - names(pa@fileList) <- nsave - - pa@puritydf$filename <- basename(pa@fileList[match(pa@puritydf$filename, old_filenames)]) - pa@grped_df$filename <- basename(pa@fileList[match(pa@grped_df$filename, old_filenames)]) - } - - - if(!all(basename(pa@fileList)==basename(xset@filepaths))){ - if(!all(names(pa@fileList)==basename(xset@filepaths))){ - print('FILELISTS DO NOT MATCH') - message('FILELISTS DO NOT MATCH') - quit(status = 1) - }else{ - xset@filepaths <- unname(pa@fileList) - } - } - - - return(list(pa, xset)) -} - - - - -option_list <- list( - make_option(c("-o", "--out_dir"), type="character"), - make_option("--pa", type="character"), - make_option("--xset_xa", type="character"), - make_option("--xcms_camera_option", type="character"), - make_option("--eic", action="store_true"), - make_option("--cores", default=4), - make_option("--mzML_files", type="character"), - make_option("--galaxy_names", type="character"), - make_option("--grp_peaklist", type="character"), - make_option("--db_name", type="character", default='lcms_data.sqlite'), - make_option("--raw_rt_columns", action="store_true"), - make_option("--metfrag_result", type="character"), - make_option("--sirius_csifingerid_result", type="character"), - make_option("--probmetab_result", type="character") -) - - -# store options -opt<- parse_args(OptionParser(option_list=option_list)) - -loadRData <- function(rdata_path, name){ - #loads an RData file, and returns the named xset object if it is there - load(rdata_path) - return(get(ls()[ls() == name])) -} - -print(paste('pa', opt$pa)) -print(opt$xset) -print(opt$xcms_camera_option) -# Requires -pa <- loadRData(opt$pa, 'pa') - - -print(pa@fileList) - - -if (opt$xcms_camera_option=='xcms'){ - xset <- loadRData(opt$xset, 'xset') - fix <- xset_pa_filename_fix(opt, pa, xset) - pa <- fix[[1]] - xset <- fix[[2]] - xa <- NULL -}else{ - - xa <- loadRData(opt$xset, 'xa') - fix <- xset_pa_filename_fix(opt, pa, xa@xcmsSet) - pa <- fix[[1]] - xa@xcmsSet <- fix[[2]] - xset <- NULL -} - - - - - -if(is.null(opt$grp_peaklist)){ - grp_peaklist = NA -}else{ - grp_peaklist = opt$grp_peaklist -} - - - - - -db_pth <- msPurity::create_database(pa, xset=xset, xsa=xa, out_dir=opt$out_dir, - grp_peaklist=grp_peaklist, db_name=opt$db_name) - -print(db_pth) - -if (!is.null(opt$eic)){ - if (is.null(opt$raw_rt_columns)){ - rtrawColumns <- FALSE - }else{ - rtrawColumns <- TRUE - } - if (is.null(xset)){ - xset <- xa@xcmsSet - } - # previous check should have matched filelists together - xset@filepaths <- unname(pa@fileList) - - # Saves the EICS into the previously created database - px <- msPurity::purityX(xset, saveEIC = TRUE, - cores=1, sqlitePth=db_pth, - rtrawColumns = rtrawColumns) -} - -con <- DBI::dbConnect(RSQLite::SQLite(), db_pth) - -add_extra_table_elucidation <- function(name, pth, db_con, filter_Score=NA, filter_Rank=NA){ - if (is.null(pth)){ - return(0) - } - chunk=50 - c = 1 - header_s = FALSE - con = file(pth, "r") - while ( TRUE ) { - line = readLines(con, n = 1) - print(line) - if ( length(line) == 0 ) { - break - } - line_v <- unlist(strsplit(line, split="\t")) - if (!header_s){ - header = line_v - header_s = TRUE - df <- data.frame(ncol=length(header), nrow=0) - print(header) - colnames(df) <- header - df_blank <- df - print('CHECK') - write_to_table(df, db_con, name, FALSE, NA, NA) - } - print(line_v) - - if (!is.na(filter_Score)){ - if (line_v[header=='Score']filter_Rank){ - next - } - } - - df <- rbind(df, line_v) - - - - if (c>chunk){ - write_to_table(df, db_con, name, TRUE, filter_Score, filter_Rank) - c=0 - df <- df_blanks - - } - c = c+1 - - print(line) - } - - - - close(con) - - -} - -write_to_table <- function(df, db_con, name, append){ - - df <- df[!df$UID=='UID',] - print(filter_Score) - print(filter_Rank) - print('filter rank and score') - - - # get peakid, an scan id - df_ids <- stringr::str_split_fixed(df$UID, '-', 3) - colnames(df_ids) <- c('grp_id', 'file_id', 'pid') - df <- cbind(df_ids, df) - DBI::dbWriteTable(db_con, name=name, value=df, row.names=FALSE, append=append) -} - -add_probmetab <- function(pth, con){ - if (!is.null(pth)){ - - df <- read.table(pth, header = TRUE, sep='\t', stringsAsFactors = FALSE, comment.char = "") - df$grp_id <- 1:nrow(df) - start <- T - for (i in 1:nrow(df)){ - - x <- df[i,] - - - if(is.na(x$proba) | x$proba =='NA'){ - - next - } - - mpc <- stringr::str_split(x$mpc, ';') - proba <- stringr::str_split(x$proba, ';') - - for (j in 1:length(mpc[[1]])){ - - row <- c(x$grp_id, x$propmz, mpc[[1]][j], proba[[1]][j]) - - if (start){ - df_out <- data.frame(t(row), stringsAsFactors=F) - start <- F - }else{ - df_out <- data.frame(rbind(df_out, row), stringsAsFactors=F) - } - print(df_out) - - } - - } - - colnames(df_out) <- c('grp_id', 'propmz', 'mpc', 'proba') - DBI::dbWriteTable(con, name='probmetab_results', value=df_out, row.names=FALSE) - - } - - -} - -add_extra_table_elucidation('metfrag_results', opt$metfrag_result, con, filter_Score=0.6, filter_Rank=NA) -add_extra_table_elucidation('sirius_csifingerid_results', opt$sirius_csifingerid_result, con, filter_Score=NA, filter_Rank=5) -add_probmetab(opt$probmetab_result, con) - - - - -cmd <- paste('SELECT cpg.grpid, cpg.mz, cpg.mzmin, cpg.mzmax, cpg.rt, cpg.rtmin, cpg.rtmax, c_peaks.cid, ', - 'c_peaks.mzmin AS c_peak_mzmin, c_peaks.mzmax AS c_peak_mzmax, ', - 'c_peaks.rtmin AS c_peak_rtmin, c_peaks.rtmax AS c_peak_rtmax, s_peak_meta.*, fileinfo.filename, fileinfo.nm_save ', - 'FROM c_peak_groups AS cpg ', - 'LEFT JOIN c_peak_X_c_peak_group AS cXg ON cXg.grpid=cpg.grpid ', - 'LEFT JOIN c_peaks on c_peaks.cid=cXg.cid ', - 'LEFT JOIN c_peak_X_s_peak_meta AS cXs ON cXs.cid=c_peaks.cid ', - 'LEFT JOIN s_peak_meta ON cXs.pid=s_peak_meta.pid ', - 'LEFT JOIN fileinfo ON s_peak_meta.fileid=fileinfo.fileid') - -print(cmd) -cpeakgroup_msms <- DBI::dbGetQuery(con, cmd) - -write.table(cpeakgroup_msms, file.path(opt$out_dir, 'cpeakgroup_msms.tsv'), row.names=FALSE, sep='\t') diff -r 7bff866f72b5 -r afe116ad4a5b flag-remove-peaks.R --- /dev/null Thu Jan 01 00:00:00 1970 +0000 +++ b/flag-remove-peaks.R Thu Jun 14 09:08:10 2018 -0400 @@ -0,0 +1,191 @@ +library(msPurity) +library(optparse) +print(sessionInfo()) +option_list <- list( + make_option(c("-o", "--out_dir"), type="character", default=getwd(), + help="Output folder for resulting files [default = %default]" + ), + make_option(c("-x", "--xset_path"), type="character", default=file.path(getwd(),"xset.rds"), + help="The path to the xcmsSet object [default = %default]" + ), + make_option("--polarity", default=NA, + help="polarity (just used for naming purpose for files being saved) [positive, negative, NA] [default %default]" + ), + make_option("--rsd_i_blank", default=100, + help="RSD threshold for the blank [default = %default]" + ), + make_option("--minfrac_blank", default=0.5, + help="minimum fraction of files for features needed for the blank [default = %default]" + ), + make_option("--rsd_rt_blank", default=100, + help="RSD threshold for the RT of the blank [default = %default]" + ), + + make_option("--ithres_blank", default=0, + help="Intensity threshold for the blank [default = %default]" + ), + make_option("--s2b", default=10, + help="fold change (sample/blank) needed for sample peak to be allowed. e.g. + if s2b set to 10 and the recorded sample 'intensity' value was 100 and blank was 10. + 1000/10 = 100, so sample has fold change higher than the threshold and the peak + is not considered a blank [default = %default]" + ), + make_option("--blank_class", default='blank', type="character", + help="A string representing the class that will be used for the blank.[default = %default]" + ), + make_option("--egauss_thr", default=NA, + help="Threshold for filtering out non gaussian shaped peaks. Note this only works + if the 'verbose columns' and 'fit gauss' was used with xcms + [default = %default]" + ), + make_option("--rsd_i_sample", default=100, + help="RSD threshold for the samples [default = %default]" + ), + make_option("--minfrac_sample", default=0.8, + help="minimum fraction of files for features needed for the samples [default = %default]" + ), + make_option("--rsd_rt_sample", default=100, + help="RSD threshold for the RT of the samples [default = %default]" + ), + make_option("--ithres_sample", default=5000, + help="Intensity threshold for the sample [default = %default]" + ), + make_option("--grp_rm_ids", default=NA, + help="vector of grouped_xcms peaks to remove (corresponds to the row from xcms::group output) + [default = %default]" + ), + make_option("--remove_spectra", action="store_true", + help=" TRUE if flagged spectra is to be removed [default = %default]" + ), + make_option("--minfrac_xcms", default=0.5, + help="minfrac for xcms grouping [default = %default]" + ), + make_option("--mzwid", default=0.001, + help="mzwid for xcms grouping [default = %default]" + ), + make_option("--bw", default=5, + help="bw for xcms grouping [default = %default]" + ), + + make_option("--temp_save", action="store_true", + help="Assign True if files for each step saved (for testing purposes) [default = %default]" + ), + + make_option("--samplelist", type="character", help="Sample list to determine the blank class"), + + make_option("--xset_name", default="xset", + help="Name of the xcmsSet object within the RData file [default = %default]" + ) + + + +) + + #make_option("--multilist", action="store_true" + # help="NOT CURRENTLY IMPLEMENTED: If paired blank removal is to be performed a - multilist - sample list file has to be provided" + #), + +# store options +opt<- parse_args(OptionParser(option_list=option_list)) + +opt <- replace(opt, opt == "NA", NA) + + + + +if (is.null(opt$temp_save)){ + temp_save<-FALSE +}else{ + temp_save<-TRUE +} + +if (is.null(opt$remove_spectra)){ + remove_spectra<-FALSE +}else{ + remove_spectra<-TRUE +} + + +print(opt) + +loadRData <- function(rdata_path, xset_name){ +#loads an RData file, and returns the named xset object if it is there + load(rdata_path) + return(get(ls()[ls() == xset_name])) +} + +xset<-loadRData(opt$xset_path, opt$xset_name) +print(xset) +if (is.null(opt$samplelist)){ + blank_class <- opt$blank_class +}else{ + samplelist <- read.table(opt$samplelist, sep='\t', header=TRUE) + samplelist_blank <- unique(samplelist$sample_class[samplelist$blank=='yes']) + + chosen_blank <- samplelist_blank[samplelist_blank %in% xset@phenoData$class] + if (length(chosen_blank)>1){ + print('ERROR: only 1 blank is currently allowed to be used with this tool') + exit() + } + blank_class <- as.character(chosen_blank) + print(blank_class) +} + + +if (is.null(opt$multilist)){ + ffrm_out <- flag_remove(xset, + pol=opt$polarity, + rsd_i_blank=opt$rsd_i_blank, + minfrac_blank=opt$minfrac_blank, + rsd_rt_blank=opt$rsd_rt_blank, + ithres_blank=opt$ithres_blank, + s2b=opt$s2b, + ref.class=blank_class, + egauss_thr=opt$egauss_thr, + rsd_i_sample=opt$rsd_i_sample, + minfrac_sample=opt$minfrac_sample, + rsd_rt_sample=opt$rsd_rt_sample, + ithres_sample=opt$ithres_sample, + minfrac_xcms=opt$minfrac_xcms, + mzwid=opt$mzwid, + bw=opt$bw, + out_dir=opt$out_dir, + temp_save=temp_save, + remove_spectra=remove_spectra, + grp_rm_ids=unlist(strsplit(as.character(opt$grp_rm_ids), split=", "))[[1]]) + print('flag remove finished') + xset <- ffrm_out[[1]] + grp_peaklist <- ffrm_out[[2]] + removed_peaks <- ffrm_out[[3]] + + save.image(file=file.path(opt$out_dir, 'xset_filtered.RData')) + + # grpid needed for mspurity ID needed for deconrank... (will clean up at some up) + peak_pth <- file.path(opt$out_dir, 'peaklist_filtered.tsv') + print(peak_pth) + write.table(data.frame('grpid'=rownames(grp_peaklist), 'ID'=rownames(grp_peaklist), grp_peaklist), + peak_pth, row.names=FALSE, sep='\t') + + removed_peaks <- data.frame(removed_peaks) + write.table(data.frame('ID'=rownames(removed_peaks),removed_peaks), + file.path(opt$out_dir, 'removed_peaks.tsv'), row.names=FALSE, sep='\t') + +}else{ + + + # TODO + #xsets <- split(xset, multilist_df$multlist) + # + #mult_grps <- unique(multilist_df$multlist) + # + #for (mgrp in mult_grps){ + # xset_i <- xsets[mgrp] + # xcms::group(xset_i, + # + # } + + + +} + + diff -r 7bff866f72b5 -r afe116ad4a5b macros.xml --- a/macros.xml Mon Jun 11 07:49:38 2018 -0400 +++ b/macros.xml Thu Jun 14 09:08:10 2018 -0400 @@ -2,8 +2,7 @@ - bioconductor-mspurity - r-optparse + bioconductor-mspurity diff -r 7bff866f72b5 -r afe116ad4a5b msp_split.py --- /dev/null Thu Jan 01 00:00:00 1970 +0000 +++ b/msp_split.py Thu Jun 14 09:08:10 2018 -0400 @@ -0,0 +1,66 @@ +from __future__ import print_function +import argparse +import textwrap +import os +import re +import csv +import math + +def msp_split(i, o, n): + spec_total = lcount('NAME', i) + spec_lim = math.ceil(spec_total/float(n)) + spec_c = 0 + filelist = [] + header = '' + print('spec_lim', spec_lim) + with open(i, 'r') as msp_in: + for i in range(1, n+1): + with open(os.path.join(o, 'file{}.msp'.format(str(i).zfill(len(str(n))))), 'w+') as msp_out: + while spec_c <= spec_lim: + if header: + msp_out.write(header) + header = '' + line = msp_in.readline() + + if not line: + break # end of file + + if re.match('^NAME:.*$', line, re.IGNORECASE): + header = line + spec_c += 1 + else: + msp_out.write(line) + spec_c = 1 + + return filelist + +def lcount(keyword, fname): + with open(fname, 'r') as fin: + return sum([1 for line in fin if keyword in line]) + +def main(): + + p = argparse.ArgumentParser(prog='PROG', + formatter_class=argparse.RawDescriptionHelpFormatter, + description='''split msp files''', + ) + + p.add_argument('-i', dest='i', help='msp file', required=True) + p.add_argument('-o', dest='o', help='out dir', required=True) + p.add_argument('-n', dest='n',) + + + args = p.parse_args() + + if not os.path.exists(args.o): + os.makedirs(args.o) + print('in file', args.i) + print('out dir', args.o) + print('nm files', args.n) + + msp_split(args.i, args.o, int(args.n)) + + +if __name__ == '__main__': + main() + diff -r 7bff866f72b5 -r afe116ad4a5b test-data/frag4feature_output.tsv --- a/test-data/frag4feature_output.tsv Mon Jun 11 07:49:38 2018 -0400 +++ b/test-data/frag4feature_output.tsv Thu Jun 14 09:08:10 2018 -0400 @@ -1,324 +1,324 @@ "grpid" "mz" "mzmin" "mzmax" "rt" "rtmin" "rtmax" "into" "intf" "maxo" "maxf" "i" "sn" "sample" "cid" "filename" "precurMtchID" "precurMtchScan" "precurMtchRT" "precurMtchMZ" "precurMtchPPM" "inPurity" "pid" -"12" 112.050766766484 112.050651550293 112.087196350098 67.47903 55.2769038 80.361672 36223791.266206 133522503.549415 7158012.5 8555976.39592391 1 21.054952458659 1 9 "dataset_28.dat" 466 462 64.427298 112.050704956055 0.55162878935702 1 384 -"12" 112.05085569128 112.050621032715 112.120460510254 67.634034 55.4140188 80.555406 36139265.8017591 133395720.51942 7426335.5 8522973.08164079 1 20.3803986860233 2 400 "dataset_27.dat" 472 468 65.376156 112.050743103027 1.00479600749392 1 1218 -"14" 113.035371704924 113.034713745117 113.059936523438 83.64567 72.171048 96.141564 92812020.095242 366177037.564437 20943314 23904502.6814248 1 27.9839052693883 2 402 "dataset_27.dat" 596 594 81.344292 113.034736633301 5.61834418239318 1 1321 -"14" 113.03541992282 113.034698486328 113.059997558594 83.441172 72.006432 95.851296 88462324.9597518 348004137.88132 18599380 22772249.3980656 1 27.431622141047 1 11 "dataset_28.dat" 604 600 81.93093 113.034736633301 6.04491512630164 1 499 -"14" 113.035371704924 113.034713745117 113.059936523438 83.64567 72.171048 96.141564 92812020.095242 366177037.564437 20943314 23904502.6814248 1 27.9839052693883 2 402 "dataset_27.dat" 667 666 90.601068 113.034713745117 5.8208310964319 0.472133563046185 1380 -"17" 116.070637437099 116.010871887207 116.070877075195 47.662548 35.592657 59.8657836 124086403.896805 465322432.631286 26501960 30360236.2301128 1 24.0791686953257 1 13 "dataset_28.dat" 277 276 40.9547952 116.070838928223 1.7359353575902 0.950632241095866 226 -"17" 116.070557825043 116.010902404785 116.070907592773 47.814411 35.7440316 60.003786 130337063.119246 491415399.75458 27555850 32138223.0150013 1 24.6441102264885 2 404 "dataset_27.dat" 277 276 41.0984136 116.070816040039 2.22463819204545 0.989376188689562 1055 -"17" 116.070637437099 116.010871887207 116.070877075195 47.662548 35.592657 59.8657836 124086403.896805 465322432.631286 26501960 30360236.2301128 1 24.0791686953257 1 13 "dataset_28.dat" 343 342 49.182402 116.070831298828 1.67020474130592 1 281 -"17" 116.070557825043 116.010902404785 116.070907592773 47.814411 35.7440316 60.003786 130337063.119246 491415399.75458 27555850 32138223.0150013 1 24.6441102264885 2 404 "dataset_27.dat" 343 342 49.3156656 116.070823669434 2.29036885341395 1 1110 -"17" 116.070557825043 116.010902404785 116.070907592773 47.814411 35.7440316 60.003786 130337063.119246 491415399.75458 27555850 32138223.0150013 1 24.6441102264885 2 404 "dataset_27.dat" 409 408 57.7060356 116.070785522461 1.96171554657148 1 1165 -"17" 116.070637437099 116.010871887207 116.070877075195 47.662548 35.592657 59.8657836 124086403.896805 465322432.631286 26501960 30360236.2301128 1 24.0791686953257 1 13 "dataset_28.dat" 410 408 57.5697876 116.070770263672 1.14435981103166 1 337 -"41" 132.101827805179 132.101791381836 132.10188293457 73.529172 61.39704 85.770306 2794252073.33772 10870343001.7354 432419872 700350921.737476 1 30.9237895882097 1 27 "dataset_28.dat" 475 474 65.949288 132.101821899414 0.0447061558976329 1 391 -"41" 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494.197875976562 50.0837946 38.0417766 62.309778 31975460.900009 125089224.818786 5749075.5 8239138.02501223 1 18.9671855740286 2 776 "dataset_31.dat" 345 342 49.3156656 494.197631835938 1.15529347093956 1 1112 +"840" 498.169308539313 498.16845703125 498.28955078125 81.162672 68.984166 93.504684 46040504.6258466 180736904.384221 9105023 11919892.2978446 1 18.9934607564632 1 389 "dataset_32.dat" 580 576 78.808182 498.168731689453 1.15793937994546 1 479 +"840" 498.169196251216 498.168304443359 498.216522216797 81.344292 69.864534 93.704046 47195241.5238887 185121008.239345 9710354 12214248.0689462 1 17.5782472187331 2 778 "dataset_31.dat" 586 582 79.776168 498.168914794922 0.564981329073345 1 1313 +"840" 498.169196251216 498.168304443359 498.216522216797 81.344292 69.864534 93.704046 47195241.5238887 185121008.239345 9710354 12214248.0689462 1 17.5782472187331 2 778 "dataset_31.dat" 657 654 89.058666 498.169708251953 1.02776474439097 1 1372 +"843" 499.250391260917 499.216522216797 499.254547119141 129.525558 116.993448 134.305698 60960211.430872 197064903.836068 13479257 15776334.7230698 1 17.5991745757 2 780 "dataset_31.dat" 937 936 126.441198 499.250396728516 0.0109516161922676 1 1605 +"843" 499.250501059464 499.216003417969 499.255126953125 129.271086 116.806434 134.058318 55312967.4069412 179331694.489759 13120593 14382850.9535263 1 18.1627514816931 1 391 "dataset_32.dat" 939 936 126.186204 499.250396728516 0.208975150626037 1 778 diff -r 7bff866f72b5 -r afe116ad4a5b test-data/peaklist_filtered.tsv --- /dev/null Thu Jan 01 00:00:00 1970 +0000 +++ b/test-data/peaklist_filtered.tsv Thu Jun 14 09:08:10 2018 -0400 @@ -0,0 +1,7 @@ +"grpid" "ID" "mzmed" "mzmin" "mzmax" "rtmed" "rtmin" "rtmax" "npeaks" "KO" "WT" "ko15" "ko16" "ko18" "wt19" "wt21" "wt22" "KO_median_I" "WT_median_I" "KO_RSD_I" "WT_RSD_I" "KO_coverage" "WT_coverage" "KO_RSD_RT" "WT_RSD_RT" "rsd_all_RT" "grpid.1" "KO_valid" "WT_valid" "all_sample_valid" "mzmin_full" "mzmax_full" "rtmin_full" "rtmax_full" +"1" "1" 205 205 205 2794.024 2793.436 2803.044 3 0 3 NA NA NA 1507943.06947222 1533767.074875 1354004.93486208 NA 1507943.06947222 NA 6.63321894286696 0 1 NA 0.19255594131829 0.19255594131829 1 0 1 1 205 205 2767.512 2816.3 +"2" "2" 231 231 231 2519.839 2504.508 2535.473 6 1 3 NA NA 30766.3350000011 45103.2999999989 104989.362833335 49776.3899999999 30766.3350000011 49776.3899999999 NA 49.9951594827002 0.333333333333333 1 NA 0.360049078987311 0.432545161192324 2 0 1 1 231 231 2507.963 2514.738 +"3" "3" 402.200012207031 402.200012207031 402.200012207031 3598.551 3592.212 3610.036 4 1 3 NA NA 14554.4999999997 37458.7453333329 91785.7281052629 142007.379692308 14554.4999999997 91785.7281052629 NA 57.8293736085665 0.333333333333333 1 NA 0.251337522585405 0.206331444617903 3 0 1 1 402.200012207031 402.200012207031 3563.503 3597.137 +"4" "4" 449.100006103516 449.100006103516 449.100006103516 2667.26 2664.638 2676.652 3 0 3 NA NA NA 6663.76999999991 11221.0499999998 6830.35200000006 NA 6830.35200000006 NA 31.3702198972974 0 1 NA 0.236631537850627 0.236631537850627 4 0 1 1 449.100006103516 449.100006103516 2659.233 2670.393 +"5" "5" 564.200012207031 564.200012207031 564.200012207031 3498.002 3491.993 3507.349 4 0 3 NA NA NA 149980.21 87237.7950000002 160589.344999999 NA 149980.21 NA 29.896461605479 0 1 NA 0.135256683436928 0.135256683436928 5 0 1 1 564.200012207031 564.200012207031 3473.214 3501.034 +"6" "6" 586.299987792969 586.299987792969 586.299987792969 3308.894 3308.249 3310.396 3 0 3 NA NA NA 10504.2799999998 7491.65500000026 12363.4999999997 NA 10504.2799999998 NA 24.294650028749 0 1 NA 0.0332903660058522 0.0332903660058522 6 0 1 1 586.299987792969 586.299987792969 3304.199 3312.024 diff -r 7bff866f72b5 -r afe116ad4a5b test-data/xset_flag_filter_input.RData Binary file test-data/xset_flag_filter_input.RData has changed