# HG changeset patch # User bgruening # Date 1557250955 14400 # Node ID 8ca108879c60ea39601207165df22a1818b58f81 # Parent f804270f3183d706e7ac732bcb6b9430aa56936d planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/spectral_hk commit ed9b6859de648aa5f7cde483732f5df20aaff90e diff -r f804270f3183 -r 8ca108879c60 spectral_hk.xml --- a/spectral_hk.xml Sat May 20 16:20:27 2017 -0400 +++ b/spectral_hk.xml Tue May 07 13:42:35 2019 -0400 @@ -1,5 +1,5 @@ - - Convert InChIs to spectral hashkeys + + - convert InChIs to spectral hashkeys spectral_hk @@ -9,7 +9,7 @@ ]]> - + @@ -24,7 +24,7 @@ + + @article{rdkit, + author = {NIH Chemical Genomics Center}, + title = {Spectral HK}, + url ={https://bitbucket.org/ncgc/spectral_hk/overview} + }