Merge pull request #48 from Luke2Sky/LucasMilitao

Fixed not using --directory argument when using mol2 files.

Author: pmbulit

scripts/multi_component_hydrogen_bond_propensity/multi_component_hydrogen_bond_propensity_report.py

@@ -413,15 +413,13 @@ def main(structure, work_directory, failure_directory, library, csdrefcode):
 
     args = parser.parse_args()
     refcode = False
-
+    args.directory = os.path.abspath(args.directory)
     if not os.path.isfile(args.input_structure):
         if len(str(args.input_structure).split('.')) == 1:
             refcode = True
         else:
             parser.error('%s - file not found.' % args.input_structure)
-    if not refcode:
-        args.directory = os.path.dirname(os.path.abspath(args.input_structure))
-    elif not os.path.isdir(args.directory):
+    if not os.path.isdir(args.directory):
         os.makedirs(args.directory)
     if not os.path.isdir(args.coformer_library):
         parser.error('%s - library not found.' % args.coformer_library)