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authorChristoph Helma <helma@in-silico.ch>2019-06-21 12:55:21 +0200
committerChristoph Helma <helma@in-silico.ch>2019-06-21 12:55:21 +0200
commitbea6f89f2a54a0612a30ce90c56c4ddecc4f7ed1 (patch)
treedc617be8c8d4ea2bad3a47398d2c0a99bbb06c56 /lib
parent7aac1c36369b41501edfc261e4f7ad77dec6b2a1 (diff)
measurement added for single neighbors
Diffstat (limited to 'lib')
-rw-r--r--lib/model.rb2
1 files changed, 1 insertions, 1 deletions
diff --git a/lib/model.rb b/lib/model.rb
index 05cd113..d7b2df6 100644
--- a/lib/model.rb
+++ b/lib/model.rb
@@ -272,7 +272,7 @@ module OpenTox
elsif neighbor_similarities.size == 1
prediction[:value] = nil
prediction[:warnings] << "Cannot create prediction: Only one similar compound for threshold #{threshold} in the training set (Threshold: #{algorithms[:similarity][:min].last})."
- prediction[:neighbors] = [{:id => neighbor_ids.first, :similarity => neighbor_similarities.first}]
+ prediction[:neighbors] = [{:id => neighbor_ids.first, :measurement => neighbor_dependent_variables[0], :similarity => neighbor_similarities.first}]
if threshold == algorithms[:similarity][:min].last
prediction[:confidence] = "Out of applicability domain: Only one similar compound in the training set."
return prediction