inprogress
[jalview.git] / forester / ruby / evoruby / lib / evo / tool / hmmscan_summary.rb
index a8f1590..08de9c1 100644 (file)
@@ -6,7 +6,6 @@
 #
 # $Id: hmmscan_parser.rb,v 1.5 2010/12/13 19:00:11 cmzmasek Exp $
 #
-# last modified: 121003
 
 require 'set'
 
@@ -14,28 +13,26 @@ require 'lib/evo/util/constants'
 require 'lib/evo/util/util'
 require 'lib/evo/util/command_line_arguments'
 require 'lib/evo/io/parser/hmmscan_parser'
-require 'lib/evo/io/parser/uniprot_parser'
-require 'lib/evo/io/web/uniprotkb'
 
 module Evoruby
 
   class HmmscanSummary
 
     PRG_NAME       = "hsp"
-    PRG_VERSION    = "2.000"
+    PRG_VERSION    = "2.002"
     PRG_DESC       = "hmmscan summary"
-    PRG_DATE       = "2012.10.23"
-    COPYRIGHT      = "2012 Christian M Zmasek"
-    CONTACT        = "phylosoft@gmail.com"
-    WWW            = "www.phylosoft.org"
+    PRG_DATE       = "130319"
+    COPYRIGHT      = "2013 Christian M Zmasek"
+    CONTACT        = "phyloxml@gmail.com"
+    WWW            = "https://sites.google.com/site/cmzmasek/home/software/forester"
 
     DELIMITER_OPTION              = "d"
+    SPECIES_OPTION                = "s"
     I_E_VALUE_THRESHOLD_OPTION    = "ie"
     FS_E_VALUE_THRESHOLD_OPTION   = "pe"
     HMM_FOR_PROTEIN_OUTPUT        = "m"
     IGNORE_DUF_OPTION             = "i"
     PARSE_OUT_DESCRIPITION_OPTION = "a"
-    UNIPROT                       = "u"
     HELP_OPTION_1                 = "help"
     HELP_OPTION_2                 = "h"
 
@@ -49,9 +46,6 @@ module Evoruby
 
     def run
 
-      ukb = UniprotKB.new
-      ukb.get
-
       Util.print_program_information( PRG_NAME,
         PRG_VERSION,
         PRG_DESC,
@@ -85,7 +79,7 @@ module Evoruby
       allowed_opts.push( IGNORE_DUF_OPTION )
       allowed_opts.push( PARSE_OUT_DESCRIPITION_OPTION )
       allowed_opts.push( HMM_FOR_PROTEIN_OUTPUT )
-      allowed_opts.push( UNIPROT )
+      allowed_opts.push( SPECIES_OPTION )
 
       disallowed = cla.validate_allowed_options_as_str( allowed_opts )
       if ( disallowed.length > 0 )
@@ -139,10 +133,10 @@ module Evoruby
         end
       end
 
-      uniprot = ""
-      if ( cla.is_option_set?( UNIPROT ) )
+      species = "HUMAN"
+      if ( cla.is_option_set?( SPECIES_OPTION ) )
         begin
-          uniprot = cla.get_option_value( UNIPROT )
+          species = cla.get_option_value( SPECIES_OPTION )
         rescue ArgumentError => e
           Util.fatal_error( PRG_NAME, "error: " + e.to_s, STDOUT )
         end
@@ -161,6 +155,7 @@ module Evoruby
       puts()
       puts( "hmmpfam outputfile  : " + inpath )
       puts( "outputfile          : " + outpath )
+      puts( "species             : " + species )
       if ( i_e_value_threshold >= 0.0 )
         puts( "i-E-value threshold : " + i_e_value_threshold.to_s )
       else
@@ -189,9 +184,6 @@ module Evoruby
       if !hmm_for_protein_output.empty?
         puts( "HMM for proteins    : " + hmm_for_protein_output )
       end
-      if !uniprot.empty?
-        puts( "Uniprot             : " + uniprot )
-      end
       puts()
 
       begin
@@ -203,13 +195,12 @@ module Evoruby
           parse_descriptions,
           fs_e_value_threshold,
           hmm_for_protein_output,
-          uniprot )
+          species )
       rescue IOError => e
         Util.fatal_error( PRG_NAME, "error: " + e.to_s, STDOUT )
       end
       domain_counts = get_domain_counts()
 
-
       puts
       puts( "domain counts (considering potential i-E-value threshold and ignoring of DUFs):" )
       puts( "(number of different domains: " + domain_counts.length.to_s + ")" )
@@ -232,9 +223,7 @@ module Evoruby
         get_descriptions,
         fs_e_value_threshold,
         hmm_for_protein_output,
-        uniprot )
-
-
+        species )
 
       Util.check_file_for_readability( inpath )
       Util.check_file_for_writability( outpath )
@@ -242,11 +231,6 @@ module Evoruby
       hmmscan_parser = HmmscanParser.new( inpath )
       results = hmmscan_parser.parse
 
-      uniprot_entries = nil
-      if !uniprot.empty? && !hmm_for_protein_output.empty?
-        uniprot_entries = read_uniprot( results, uniprot  )
-      end
-
       outfile = File.open( outpath, "a" )
 
       query     = ""
@@ -258,8 +242,6 @@ module Evoruby
 
       hmmscan_results_per_protein = []
 
-
-
       prev_query = ""
 
       results.each do | r |
@@ -295,7 +277,7 @@ module Evoruby
                 fs_e_value_threshold,
                 hmm_for_protein_output,
                 i_e_value_threshold,
-                uniprot_entries )
+                species )
             end
             hmmscan_results_per_protein.clear
           end
@@ -310,17 +292,17 @@ module Evoruby
           end
         end
       end
+
       if !hmm_for_protein_output.empty? && !hmmscan_results_per_protein.empty?
         process_hmmscan_results_per_protein( hmmscan_results_per_protein,
           fs_e_value_threshold,
           hmm_for_protein_output,
           i_e_value_threshold,
-          uniprot_entries )
+          species )
       end
 
       outfile.flush()
       outfile.close()
-
     end # def parse
 
     def process_id( id )
@@ -330,17 +312,6 @@ module Evoruby
       id
     end
 
-    def read_uniprot( hmmscan_results, uniprot  )
-      ids = Set.new
-      hmmscan_results.each do | r |
-
-        ids << process_id( r.query )
-      end
-      uniprot_parser = UniprotParser.new uniprot
-      uniprot_entries = uniprot_parser.parse ids
-      uniprot_entries
-    end
-
     def count_model( model )
       if ( @domain_counts.has_key?( model ) )
         count = @domain_counts[ model ].to_i
@@ -355,7 +326,7 @@ module Evoruby
         fs_e_value_threshold,
         hmm_for_protein_output,
         i_e_value_threshold,
-        uniprot_entries )
+        species )
 
       dc = 0
       # filter according to i-Evalue threshold
@@ -363,12 +334,14 @@ module Evoruby
       hmmscan_results_per_protein_filtered = []
 
       hmmscan_results_per_protein.each do | r |
+
+
         if r.model == hmm_for_protein_output
-          if r.fs_e_value > fs_e_value_threshold
+          if fs_e_value_threshold > 0.0 && r.fs_e_value > fs_e_value_threshold
             return
           end
         end
-        if r.i_e_value <= i_e_value_threshold
+        if i_e_value_threshold <= 0 || r.i_e_value <= i_e_value_threshold
           hmmscan_results_per_protein_filtered << r
           if r.model == hmm_for_protein_output
             dc += 1
@@ -392,7 +365,7 @@ module Evoruby
 
       s = ""
       s << own.query + "\t"
-      s << "HUMAN" + "\t"
+      s << species + "\t"
       s << own.fs_e_value.to_s + "\t"
       s << own.qlen.to_s + "\t"
       s << dc.to_s + "\t"
@@ -401,32 +374,15 @@ module Evoruby
         s << r.model + " "
       end
       s << "\t"
-      e = uniprot_entries[ process_id( own.query ) ]
-      if e != nil && e.de != nil
-        e.de.each { |i| s << i + " " }
-      else
-        s << "-"
-      end
-      s << "\t"
-
-      if e != nil && e.gn != nil
-        e.gn.each { |i| s << i + " " }
-      else
-        s << "-"
-      end
-
 
-
-      s << "\t"
       overview = make_overview( hmmscan_results_per_protein_filtered, hmm_for_protein_output )
 
-      s << overview   + "\t"
+      s << overview  + "\t"
 
       s << calc_linkers(  hmmscan_results_per_protein_filtered, hmm_for_protein_output )  + "\t"
 
       prev_r = nil
       hmmscan_results_per_protein_filtered.each do | r |
-
         if  prev_r != nil
           s << make_interdomain_sequence( r.env_from - prev_r.env_to - 1 )
         else
@@ -440,11 +396,10 @@ module Evoruby
         s << "]"
         prev_r = r
       end
-      s << make_interdomain_sequence( own.qlen - prev_r.env_from, false )
+      s << make_interdomain_sequence( own.qlen - prev_r.env_to, false )
       puts s
     end
 
-
     def calc_linkers(  hmmscan_results_per_protein_filtered, hmm_for_protein_output )
       linkers = ""
       prev_r = nil
@@ -499,7 +454,6 @@ module Evoruby
     end
 
 
-
     def print_help()
       puts( "Usage:" )
       puts()
@@ -511,6 +465,7 @@ module Evoruby
       puts( "           -" + IGNORE_DUF_OPTION  + ": ignore DUFs" )
       puts( "           -" + FS_E_VALUE_THRESHOLD_OPTION  + ": E-value threshold for full protein sequences, only for protein summary" )
       puts( "           -" + HMM_FOR_PROTEIN_OUTPUT + ": HMM for protein summary" )
+      puts( "           -" + SPECIES_OPTION + ": species for protein summary" )
       puts()
     end