# HG changeset patch # User bgruening # Date 1595938342 0 # Node ID 070f0e96733bbdf10edf83c120e6dc11c0d6bc56 # Parent 3b20a6bf613a6a848dc001eb596e207e57ff3942 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/sucos commit 944ea4bb8a9cd4244152a4a4fecd0485fabc2ad0" diff -r 3b20a6bf613a -r 070f0e96733b sucos.xml --- a/sucos.xml Wed Apr 15 13:25:24 2020 +0000 +++ b/sucos.xml Tue Jul 28 12:12:22 2020 +0000 @@ -1,7 +1,8 @@ - + - compare shape and feature overlap of docked ligand poses to a reference molecule sucos_macros.xml + 0 + 2020.03.4 10.26434/chemrxiv.8100203.v1 @@ -12,7 +13,7 @@ - rdkit + rdkit