From b90720cc26d789a96fa6f7a054fe06fc8b4ef33d Mon Sep 17 00:00:00 2001
From: Christoph Helma <helma@in-silico.ch>
Date: Sat, 27 Feb 2016 16:47:48 +0100
Subject: local pls regression as default regression algorithm

---
 lib/compound.rb | 1 +
 1 file changed, 1 insertion(+)

(limited to 'lib/compound.rb')

diff --git a/lib/compound.rb b/lib/compound.rb
index 8f37247..d5d6aa9 100644
--- a/lib/compound.rb
+++ b/lib/compound.rb
@@ -23,6 +23,7 @@ module OpenTox
     field :sdf_id, type: BSON::ObjectId
     field :molecular_weight, type: Float
     field :fingerprints, type: Hash, default: {}
+    field :physchem, type: Hash, default: {}
     field :default_fingerprint_size, type: Integer
     field :dataset_ids, type: Array, default: []
     field :features, type: Hash, default: {}
-- 
cgit v1.2.3