From a2e3dbb4d8ec9e4154a2a97c532d393a760f97fd Mon Sep 17 00:00:00 2001 From: Alon Grinberg Dana Date: Sat, 29 Jun 2024 09:30:23 +0300 Subject: [PATCH] Fix incorrect key in TSGuess.from_dict() --- arc/species/species.py | 2 +- 1 file changed, 1 insertion(+), 1 deletion(-) diff --git a/arc/species/species.py b/arc/species/species.py index 8ab01766eb..af81f40431 100644 --- a/arc/species/species.py +++ b/arc/species/species.py @@ -2218,7 +2218,7 @@ def from_dict(self, ts_dict: dict): else ts_dict['execution_time'] if 'execution_time' in ts_dict else None self.method = ts_dict['method'].lower() if 'method' in ts_dict else 'user guess' self.method_index = ts_dict['method_index'] if 'method_index' in ts_dict else None - self.method_direction = ts_dict['method_direction'] if 'method_index' in ts_dict else None + self.method_direction = ts_dict['method_direction'] if 'method_direction' in ts_dict else None self.imaginary_freqs = ts_dict['imaginary_freqs'] if 'imaginary_freqs' in ts_dict else None self.conformer_index = ts_dict['conformer_index'] if 'conformer_index' in ts_dict else None self.successful_irc = ts_dict['successful_irc'] if 'successful_irc' in ts_dict else None