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| author | Christoph Helma <helma@in-silico.ch> | 2016-02-27 16:47:48 +0100 |
|---|---|---|
| committer | Christoph Helma <helma@in-silico.ch> | 2016-02-27 16:47:48 +0100 |
| commit | b90720cc26d789a96fa6f7a054fe06fc8b4ef33d (patch) | |
| tree | 3c5e28e4576b31eb66d1bc29a7c2abea38802bb3 /lib/compound.rb | |
| parent | e778475c578f13f30af4437845716d7e781c2609 (diff) | |
local pls regression as default regression algorithmfminer
Diffstat (limited to 'lib/compound.rb')
| -rw-r--r-- | lib/compound.rb | 1 |
1 files changed, 1 insertions, 0 deletions
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: {} |