Skip to content

Commit 8fb0055

Browse files
committed
Code cleanup
1 parent 25152df commit 8fb0055

File tree

1 file changed

+0
-3
lines changed

1 file changed

+0
-3
lines changed

arc/job/adapters/ts/heuristics.py

-3
Original file line numberDiff line numberDiff line change
@@ -1075,9 +1075,6 @@ def h_abstraction(arc_reaction: 'ARCReaction',
10751075

10761076
try:
10771077
h_abs_atoms_dict = get_h_abs_atoms(df_dmat)
1078-
a = extract_digits(h_abs_atoms_dict['A'])
1079-
h = extract_digits(h_abs_atoms_dict['H'])
1080-
b = extract_digits(h_abs_atoms_dict['B'])
10811078
crest_path = crest_ts_conformer_search(xyz_guess_crest, a, h, b, path=path)
10821079
crest_paths.append(crest_path)
10831080
except (ValueError, KeyError) as e:

0 commit comments

Comments
 (0)