# HG changeset patch # User chemteam # Date 1586260746 14400 # Node ID d09f116dfca5bafa297c0c5eabc39790d1818620 # Parent 52e64e8cf20347b6c343218cedaf145d57b3dbff "planemo upload for repository https://github.com/galaxycomputationalchemistry/galaxy-tools-compchem/ commit 3664d8011044773cc3250ce15d712d97b0b91373" diff -r 52e64e8cf203 -r d09f116dfca5 mmpbsa_mmgbsa.xml --- a/mmpbsa_mmgbsa.xml Fri Feb 28 03:47:30 2020 -0500 +++ b/mmpbsa_mmgbsa.xml Tue Apr 07 07:59:06 2020 -0400 @@ -1,4 +1,4 @@ - + - estimate ligand binding affinities @@ -10,7 +10,8 @@