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-rwxr-xr-xscripts/lazar-cv-predictions.rb33
1 files changed, 5 insertions, 28 deletions
diff --git a/scripts/lazar-cv-predictions.rb b/scripts/lazar-cv-predictions.rb
index 9236bec..9f94776 100755
--- a/scripts/lazar-cv-predictions.rb
+++ b/scripts/lazar-cv-predictions.rb
@@ -1,31 +1,8 @@
#!/usr/bin/env ruby
-predictions = {}
-minsim = ARGV[1].to_f
-minsim ||= 0
-Dir[File.join(ARGV[0],"crossvalidation","*","test","predictions")].each do |pred|
- File.readlines(pred).each_with_index do |l,i|
- smi,m,pred,pa,pi,maxsim,n = l.split(",")
- predictions[smi] = [pred,maxsim.to_f]
- end
-end
-lines = File.readlines(File.join("mutagenicity","mutagenicity.csv"))
-lines.shift
-lines.each do |line|
- smi,exp = line.chomp.split(",")
- if predictions[smi]
- if predictions[smi].first == "1" and exp == "1" and predictions[smi].last >= minsim
- puts [smi,"TP"].join(",")
- elsif predictions[smi].first == "0" and exp == "0" and predictions[smi].last >= minsim
- puts [smi,"TN"].join(",")
- elsif predictions[smi].first == "1" and exp == "0" and predictions[smi].last >= minsim
- puts [smi,"FP"].join(",")
- elsif predictions[smi].first == "0" and exp == "1" and predictions[smi].last >= minsim
- puts [smi,"FN"].join(",")
- else
- puts [smi,"NA"].join(",")
- end
- else
- puts [smi,"NA"].join(",")
- end
+thresh = ARGV[1].to_f
+thresh ||= 0
+File.readlines(ARGV[0]).each do |pred|
+ smi,c,maxsim = pred.split(",")
+ puts [smi,c].join(",") if maxsim.to_f > thresh
end