diff options
Diffstat (limited to 'lib/utils.rb')
-rw-r--r-- | lib/utils.rb | 3 |
1 files changed, 2 insertions, 1 deletions
diff --git a/lib/utils.rb b/lib/utils.rb index 555ac17..d34081b 100644 --- a/lib/utils.rb +++ b/lib/utils.rb @@ -312,7 +312,8 @@ module OpenTox sdf_data = [] params[:compounds].each_with_index { |c_uri, c_idx| cmpd = OpenTox::Compound.new(c_uri) - LOGGER.debug "3D for #{cmpd.to_smiles}" + #LOGGER.debug "3D for #{cmpd.to_smiles}" + LOGGER.debug "3D for #{c_idx}" obconv = OpenBabel::OBConversion.new obmol = OpenBabel::OBMol.new obconv.set_in_format("smi") |