# HG changeset patch # User chemteam # Date 1567191774 14400 # Node ID ddb1ae2cf028f293d81f8646f60f1cc3676aacf6 # Parent 0b8a0ce446f5d60eb4506b3f3023a86ef1f3df36 "planemo upload for repository https://github.com/galaxycomputationalchemistry/galaxy-tools-compchem commit b1b74e91a242f2de250761a79b17d77e68b1045f" diff -r 0b8a0ce446f5 -r ddb1ae2cf028 packmol.xml --- a/packmol.xml Mon Oct 08 05:31:29 2018 -0400 +++ b/packmol.xml Fri Aug 30 15:02:54 2019 -0400 @@ -1,5 +1,5 @@ - Initial configurations for Molecular Dynamics Simulations by packing optimization + Initial configurations for Molecular Dynamics simulations by packing optimization macros_packmol.xml