From 6ab86c253ba0eb79b9e6a20effa2d18626accf2b Mon Sep 17 00:00:00 2001 From: Christoph Helma Date: Thu, 13 Aug 2015 11:56:40 +0200 Subject: OpenBabel can (canonical smiles) instead of inchi as internal identifier to avoid OpenBabel InChi bug. --- lib/lazar.rb | 2 +- 1 file changed, 1 insertion(+), 1 deletion(-) (limited to 'lib/lazar.rb') diff --git a/lib/lazar.rb b/lib/lazar.rb index 2e7e7c2..0c5e18b 100644 --- a/lib/lazar.rb +++ b/lib/lazar.rb @@ -58,7 +58,7 @@ CLASSES = ["Feature","Compound","Dataset","Validation","CrossValidation"]# Algor "algorithm.rb", "descriptor.rb", "bbrc.rb", - "lazar.rb", + "lazar-model.rb", "similarity.rb", "neighbor.rb", "classification.rb", -- cgit v1.2.3