Mercurial > repos > melpetera > acorf
view ACorF/lib/IonFiltration.pm @ 1:26aa3a8f95ce draft
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author | melpetera |
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date | Wed, 30 Oct 2019 06:54:20 -0400 |
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#!usr/bin/perl package IonFiltration; ### Perl modules use strict; use warnings; ######################################################################## ### Création of a hash containing all adduits and fragments possible ### ######################################################################## sub MassCollecting{ my $mass_file = $_[0]; my %hmass; open (F1, $mass_file); while(my $line = <F1>){ chomp $line; my @tline = split(/[\t;]/, $line); if(defined($hmass{$tline[2]})){ print "The mass difference already exists : $tline[2] !\n"; } $hmass{$tline[1]}{$tline[2]}=$tline[0]; } close F1; return %hmass; } ######################################################## ### Creation of a sif table + correlation filtration ### ######################################################## sub sifTableCreation{ my $file = $_[0]; my $output_sif = $_[1]; # my $opt = $_[2]; # my $rt_threshold = $_[3]; # my $mass_threshold = $_[4]; my $correl_threshold = $_[5]; # my $dataMatrix = $_[6]; # my $output_tabular = $_[7]; my $combined_DMVM = $_[8]; # my $repres_opt = $_[9]; # my $intensity_threshold = $_[10]; # my $intensity_pourc = $_[11]; # my $refhmass = $_[12]; my %hheader_file; my %hduplicate; my %hcorrelgroup; my $groupct=1; my $linenb3=0; my %hheader_line; my %hrtmz; open (F5, $combined_DMVM); while(my $line = <F5>){ chomp $line; my @tline = split(/\t/, $line); if($linenb3 == 0){ for(my $i=0; $i<scalar(@tline);$i++){ my $a = $tline[$i]; $hheader_line{$a}=$i; } } else{ if(defined($hheader_line{mzmed})){ my $b = $tline[$hheader_line{mzmed}]; $hrtmz{$tline[0]}{mz}=$b; } else{ my $b = $tline[$hheader_line{mz}]; $hrtmz{$tline[0]}{mz}=$b; } if(defined($hheader_line{rtmed})){ my $d = $tline[$hheader_line{rtmed}]; $hrtmz{$tline[0]}{rt}=$d; } else{ my $d = $tline[$hheader_line{rt}]; $hrtmz{$tline[0]}{rt}=$d; } } $linenb3 ++; } close F5; my $linenb=0; open (F1, $file) or die "Impossible to open $file\n"; open(F2, ">$output_sif") or die "Impossible to open $output_sif\n"; while(my $line = <F1>){ chomp $line; my @tline = split(/\t/, $line); ############################### ### Création of a sif table ### ############################### if($linenb == 0){ for(my $i=0; $i<scalar(@tline);$i++){ my $a = $tline[$i]; $hheader_file{$i}=$a; } } else{ for(my $i=1; $i<scalar(@tline);$i++){ my $a=$tline[0]; my $b=$hheader_file{$i}; my $coef=$tline[$i]; if($a eq $b){ # print "This is a correlation between A ($a) and A ($b) !\n" } else{ ######################### ### Remove duplicates ### ######################### my $y = $a."/".$b; my $z = $b."/".$a; if((!(defined($hduplicate{$y}))) && (!(defined($hduplicate{$z})))){ $hduplicate{$y}=1; # my $abcoef=abs($coef); # Only when you want to consider negative correlations # if($abcoef > $correl_threshold){ # Only when you want to consider negative correlations if($coef > $correl_threshold){ print F2 "$a\t$coef\t$b\n"; my $count=0; } } } } } $linenb ++; } close F1; close F2; return ($output_sif, %hrtmz); } 1;