diff --git a/Longbow/plugins/apps/namd.py b/Longbow/plugins/apps/namd.py index ce580c1..2db0334 100644 --- a/Longbow/plugins/apps/namd.py +++ b/Longbow/plugins/apps/namd.py @@ -85,7 +85,7 @@ def file_parser(filename, path, files, substitutions=None): # Define keywords and create a dictionary for variable substitutions keywords = ['coordinates', 'extendedsystem', 'structure', 'parameters', 'paraTypeXplor', 'paraTypeCharmm', 'velocities', - 'binvelocities', 'bincoordinates'] + 'binvelocities', 'bincoordinates', 'ambercoor', 'parmfile'] variables = {} fil = None