diff --git a/scripts/public/preparation/constrained_relax.xml b/scripts/public/preparation/constrained_relax.xml new file mode 100644 index 0000000..e8a5f38 --- /dev/null +++ b/scripts/public/preparation/constrained_relax.xml @@ -0,0 +1,36 @@ + +# I think this is a match for the flagset for relaxing a protein (preparatory to other Rosetta work) that AJ Vincelli showed at summer rosettacon 2020 +# Steven Lewis smlewi@gmail.com + + + + + + + + + + + + + + + + + + + + + + + diff --git a/scripts_to_parse.py b/scripts_to_parse.py index 4baca2c..67fbf33 100644 --- a/scripts_to_parse.py +++ b/scripts_to_parse.py @@ -14,6 +14,7 @@ "scripts/public/docking/terpeneSynthase_docking.xml", "scripts/public/protein_hacking/helix_extend_with_threading.xml", "scripts/public/loop_modeling/simple_loop_grower/simple_loop_grower.xml", + "/scripts/public/preparation/constrained_relax.xml", "scripts/public/protein_hacking/helix_extender.xml", "scripts/public/point_mutant_scan/point_mutant_scan.xml", "scripts/pilot/symmetry/symm.xml",