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view lib/golm_ws_api.pm @ 0:e3d43b8c987b draft
Init repository with last tool-bank-golm-lib_search master version
author | fgiacomoni |
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date | Mon, 05 Dec 2016 08:32:04 -0500 |
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children | 11779b6402bc |
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package lib::golm_ws_api ; use strict; use warnings ; use Exporter ; use Carp ; use Data::Dumper ; #use SOAP::Lite +trace => [qw (debug)]; use SOAP::Lite ; use JSON ; use vars qw($VERSION @ISA @EXPORT %EXPORT_TAGS); our $VERSION = "1.0"; our @ISA = qw(Exporter); our @EXPORT = qw( connectWSlibrarySearchGolm LibrarySearch test_query_golm filter_scores_golm_results filter_replica_results); our %EXPORT_TAGS = ( ALL => [qw( connectWSlibrarySearchGolm LibrarySearch test_query_golm filter_scores_golm_results filter_replica_results)] ); =head1 NAME My::Module - An example module =head1 SYNOPSIS use My::Module; my $object = My::Module->new(); print $object->as_string; =head1 DESCRIPTION This module does not really exist, it was made for the sole purpose of demonstrating how POD works. =head1 METHODS Methods are : =head2 METHOD new ## Description : new ## Input : $self ## Ouput : bless $self ; ## Usage : new() ; =cut sub new { ## Variables my $self={}; bless($self) ; return $self ; } ### END of SUB =head2 METHOD connectWSlibrarySearchGolm ## Description : create a soap object throught the webservice LibrarySearch of Golm. ## Input : $ws_url, $ws_proxy ## Ouput : $soap ; ## Usage : my $soap = connectWSlibrarySearchGolm($ws_url, $ws_proxy) ; =cut sub connectWSlibrarySearchGolm() { ## Retrieve Values my $self = shift ; my ($ws_url, $ws_proxy) = @_ ; my $osoap = SOAP::Lite -> soapversion('1.2') -> envprefix('soap12') -> readable(1) -> uri( $ws_url ) -> proxy( $ws_proxy."/" ) -> on_fault(sub { my($soap, $res) = @_; eval { die ref $res ? $res->faultstring : $soap->transport->status, "\n"}; return ref $res ? $res : new SOAP::SOM ; }); return ($osoap); } ### END of SUB =head2 METHOD test_query_golm ## Description : send a test request (default given on ws website) to golm database. ## Input : $ws_url, $ws_proxy ## Ouput : $soap ; ## Usage : my $soap = test_query_golm($ws_url, $ws_proxy) ; =cut sub test_query_golm() { ## Retrieve Values my $self = shift ; my ($ws_url, $ws_proxy) = @_ ; my $soap = SOAP::Lite -> uri($ws_url) -> on_action( sub { join '/', $ws_proxy, $_[1] } ) -> proxy($ws_proxy, timeout => 500); # Setting Content-Type myself my $http_request = $soap ->{'_transport'} ->{'_proxy'} ->{'_http_request'}; $http_request->content_type("text/xml; charset=utf-8"); my $method = SOAP::Data->name('LibrarySearch') ->attr({xmlns => $ws_proxy."/"}); my @params = ( SOAP::Data->name('ri' => 1898), SOAP::Data->name('riWindow' => 5), SOAP::Data->name('AlkaneRetentionIndexGcColumnComposition' => 'VAR5'), SOAP::Data->name('spectrum' => "70 3 71 3 72 16 73 999 74 87 75 78 76 4 77 5 81 1 82 6 83 13 84 4 85 3 86 4 87 5 88 4 89 52 90 4 91 2 97 2 98 1 99 4 100 12 101 16 102 9 103 116 104 11 105 26 106 2 107 1 111 1 112 1 113 4 114 11 115 7 116 5 117 93 118 9 119 8 126 1 127 3 128 3 129 101 130 19 131 25 132 4 133 60 134 8 135 4 140 1 141 1 142 4 143 13 144 2 145 6 146 1 147 276 148 44 149 27 150 3 151 1 156 1 157 70 158 12 159 5 160 148 161 26 162 7 163 8 164 1 168 1 169 2 170 1 172 3 173 4 174 1 175 4 177 4 186 2 187 1 189 28 190 7 191 13 192 2 193 1 201 5 202 1 203 3 204 23 205 162 206 31 207 16 208 2 210 2 214 1 215 2 216 8 217 88 218 18 219 8 220 1 221 6 222 1 229 23 230 6 231 11 232 3 233 4 234 3 235 1 243 1 244 2 245 1 246 2 247 1 256 1 262 3 263 1 269 2 270 1 274 4 275 1 277 4 278 1 291 7 292 2 293 1 300 1 305 4 306 1 307 4 308 1 318 1 319 122 320 37 321 17 322 3 323 1 343 1 364 2 365 1" ) ); my $som = $soap->call($method => @params); die $som->faultstring if ($som->fault); ## Get the hits + status of the query my $results = $som->result->{Results} ; my $status = $som->result->{Status} ; if ($status eq 'success' && $results ne '') { print "\n\n\nThe test request succeeded - Golm Service available.\n\n\n" ; return 1 ; } else { croak "\n\n\nSomething went wrong with the test request. Status delivered by Golm = ".$status."\n\n" ; } } ### END of SUB =head2 METHOD LibrarySearch ## Description : Matches a single user submitted GC-EI mass spectrum against the Golm Metabolome Database (GMD). ## A limited amount of hits can be kept according to the maxHits value and after them being filtered by $filter value ## Input : $osoap, $ri, $riWindow, $gcColumn, $spectrum, $maxHits ## Ouput : \@limited_hits, \@json_res ## Usage : ($limited_hits,$json_res) = LibrarySearch($osoap, $ri, $riWindow, $gcColumn, $spectrum, $maxHits) ; =cut sub LibrarySearch() { ## Retrieve Values my $self = shift ; my ($ri, $riWindow, $gcColumn, $spectrum, $maxHits,$JaccardDistanceThreshold,$s12GowerLegendreDistanceThreshold,$DotproductDistanceThreshold, $HammingDistanceThreshold,$EuclideanDistanceThreshold, $ws_url, $ws_proxy, $default_ri, $default_ri_window, $default_gc_column) = @_ ; #init in case : $ri = $default_ri if ( !defined $ri ) ; $riWindow = $default_ri_window if ( !defined $riWindow ) ; $gcColumn = $default_gc_column if ( !defined $gcColumn ) ; my $result ; my @filtered_limited_res = () ; my @json_res ; if ( defined $spectrum ){ if ( $spectrum ne '' ) { my $soap = SOAP::Lite -> uri($ws_url) -> on_action( sub { join '/', $ws_proxy, $_[1] } ) -> proxy($ws_proxy); # Setting Content-Type myself my $http_request = $soap ->{'_transport'} ->{'_proxy'} ->{'_http_request'}; $http_request->content_type("text/xml; charset=utf-8"); my $method = SOAP::Data->name('LibrarySearch') ->attr({xmlns => $ws_proxy."/"}); my @params = ( SOAP::Data->name('ri' => $ri), SOAP::Data->name('riWindow' => $riWindow), SOAP::Data->name('AlkaneRetentionIndexGcColumnComposition' => $gcColumn), SOAP::Data->name('spectrum' => $spectrum) ) ; my $som = $soap->call($method => @params); die $som->faultstring if ($som->fault); ## Get the hits + status of the query my $results = $som->result->{Results} ; my $status = $som->result->{Status} ; ## Limitate number of hits returned according to user's $maxHit ## and filter hits on specific values with thresholds my @results = @$results ; ### Return all hits my $oapi = lib::golm_ws_api->new() ; if ($maxHits == 100 && $status eq 'success') { my $filtered_res = $oapi->filter_scores_golm_results(\@results,$JaccardDistanceThreshold,$s12GowerLegendreDistanceThreshold, $DotproductDistanceThreshold,$HammingDistanceThreshold,$EuclideanDistanceThreshold) ; if(!@$filtered_res){ push (@$filtered_res , "no results") ; } return ($filtered_res) ; } elsif ($maxHits < 100 && $maxHits > 0 && $status eq 'success'){ my $filtered_res_before_hits_limited = $oapi->filter_scores_golm_results(\@results,$JaccardDistanceThreshold,$s12GowerLegendreDistanceThreshold, $DotproductDistanceThreshold,$HammingDistanceThreshold,$EuclideanDistanceThreshold) ; if (@$filtered_res_before_hits_limited) { for (my $i=0 ; $i<$maxHits ; $i++) { push (@filtered_limited_res , @$filtered_res_before_hits_limited[$i]) ; } } else { if(!@$filtered_res_before_hits_limited){ push (@filtered_limited_res , "no results") ; } } return (\@filtered_limited_res) ; } else { carp "No match returned from Golm for the query.\n" } } else { carp "The spectrum for query is empty, Golm soap will stop.\n" ; } } else { carp "The spectrum for query is undef, Golm soap will stop.\n" ; } return \@filtered_limited_res ; } ### END of SUB =head2 METHOD filter_scores_golm_results ## Description : filter golm's hits by distance scores ## Input : $results,$JaccardDistanceThreshold,$s12GowerLegendreDistanceThreshold, ## $DotproductDistanceThreshold,$HammingDistanceThreshold,$EuclideanDistanceThreshold ## Ouput : \@filtered_res ; ## Usage : my ($filtered_res) = filter_scores_golm_results($results,$JaccardDistanceThreshold,$s12GowerLegendreDistanceThreshold, ## $DotproductDistanceThreshold,$HammingDistanceThreshold,$EuclideanDistanceThreshold) ; =cut sub filter_scores_golm_results() { ## Retrieve Values my $self = shift ; my ($results,$JaccardDistanceThreshold,$s12GowerLegendreDistanceThreshold, $DotproductDistanceThreshold,$HammingDistanceThreshold,$EuclideanDistanceThreshold) = @_ ; my @results = @$results ; my @filtered_res = () ; foreach my $res (@results){ if ($res->{'JaccardDistance'} <= $JaccardDistanceThreshold && $res->{'s12GowerLegendreDistance'} <= $s12GowerLegendreDistanceThreshold && $res->{'DotproductDistance' } <= $DotproductDistanceThreshold && $res->{'HammingDistance'} <= $HammingDistanceThreshold && $res->{'EuclideanDistance' } <= $EuclideanDistanceThreshold) { push (@filtered_res , $res) ; } } my $oapi = lib::golm_ws_api->new() ; my $sorted_analytes = $oapi->filter_replica_results(\@filtered_res) ; return $sorted_analytes ; } =head2 METHOD _filter_replica_results ## Description : remove replicated hits, keep the ones with the lowest dot product distance ## Input : $results ## Ouput : \@clean_res ; ## Usage : my ($clean_res) = filter_replica_results($results) ; =cut sub filter_replica_results() { ## Retrieve Values my $self = shift ; my ($results) = @_ ; my %seen ; my @sortAnalytes = grep { !$seen{$_->{'analyteName'}}++ } sort { $a->{'DotproductDistance'} <=> $b->{'DotproductDistance'} } @$results ; return \@sortAnalytes ; } 1 ; __END__ =head1 SUPPORT You can find documentation for this module with the perldoc command. perldoc golm_ws_api.pm =head1 Exports =over 4 =item :ALL is connectWSlibrarySearchGolm LibrarySearch test_query_golm filter_scores_golm_results filter_replica_results =back =head1 AUTHOR Franck Giacomoni E<lt>franck.giacomoni@clermont.inra.frE<gt> Gabriel Cretin E<lt>gabriel.cretin@clermont.inra.frE<gt> =head1 LICENSE This program is free software; you can redistribute it and/or modify it under the same terms as Perl itself. =head1 VERSION version 1 : 03 / 06 / 2016 version 2 : 24 / 06 / 2016 =cut