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authorAndreas Maunz <andreas@maunz.de>2011-05-11 01:41:11 -0700
committerAndreas Maunz <andreas@maunz.de>2011-05-11 01:41:11 -0700
commitd434ab913b637c6334b159f603596e5ea95cbdc5 (patch)
tree6c4c20e473e1721b23a407c6c2acfdc179848577
parent5cad3a029a22c8a2ae6bb56458a47051ebcf8000 (diff)
Hotfix: p_value and SMARTS matching
-rw-r--r--fminer.rb7
1 files changed, 2 insertions, 5 deletions
diff --git a/fminer.rb b/fminer.rb
index 2e663e7..d0ea4f4 100644
--- a/fminer.rb
+++ b/fminer.rb
@@ -270,7 +270,7 @@ post '/fminer/last/?' do
smi = [] # AM LAST: needed for matching the patterns back
nr_active=0
nr_inactive=0
- all_activities = Hash.new# DV: for effect calculation in regression part
+ all_activities = Hash.new #DV: for effect calculation (class and regr)
training_dataset.data_entries.each do |compound,entry|
begin
@@ -315,9 +315,6 @@ post '/fminer/last/?' do
end
end
end
-
- g_array=all_activities.values # DV: calculation of global median for effect calculation
- g_median=OpenTox::Algorithm.median(g_array)
raise "No compounds in dataset #{training_dataset.uri}" if compounds.size==0
@@ -349,7 +346,7 @@ post '/fminer/last/?' do
OT.isA => OT.Substructure,
OT.hasSource => feature_dataset.uri,
OT.smarts => smarts,
- OT.pValue => p_value.to_f,
+ OT.pValue => p_value.to_f.abs,
OT.effect => effect,
OT.parameters => [
{ DC.title => "dataset_uri", OT.paramValue => params[:dataset_uri] },