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authorChristoph Helma <helma@in-silico.ch>2018-08-23 17:08:34 +0200
committerChristoph Helma <helma@in-silico.ch>2018-08-23 17:08:34 +0200
commit3146140b2530bc89d13c494f2e4317b952fc31cc (patch)
tree10fd82e10e23c69ec7c36e8bc88345a9b4c3941d /scripts/pa_neighbor_sets.rb
parentc94ac24d68c137e93d11f0a7d7621ab0b2e808d7 (diff)
unique neighbor sets
Diffstat (limited to 'scripts/pa_neighbor_sets.rb')
-rwxr-xr-xscripts/pa_neighbor_sets.rb16
1 files changed, 16 insertions, 0 deletions
diff --git a/scripts/pa_neighbor_sets.rb b/scripts/pa_neighbor_sets.rb
new file mode 100755
index 0000000..1975ffd
--- /dev/null
+++ b/scripts/pa_neighbor_sets.rb
@@ -0,0 +1,16 @@
+#!/usr/bin/env ruby
+require_relative '../../lazar/lib/lazar'
+include OpenTox
+
+results = JSON.parse File.read(ARGV[0])
+neighbors = []
+results.each do |s,r|
+ neighbors << r["neighbors"] if r["value"]
+end
+
+o = {
+ :nr_predictions => neighbors.size,
+ :unique_neighbor_sets => neighbors.uniq.size,
+ :unique_neighbor_sets_without_similarity => neighbors.collect{|s| s.collect{|n| n["id"]}.sort}.uniq.size
+}
+puts o.to_json