From 12f16c306c89cc273bebe90bc0ffc227f2a6f3a3 Mon Sep 17 00:00:00 2001 From: Mahmoud-ma2103840 <158025114+Mahmoud-ma2103840@users.noreply.github.com> Date: Mon, 8 Jul 2024 09:32:08 +0300 Subject: [PATCH] Update utils.py Changed .append to ._append --- moses/metrics/utils.py | 2 +- 1 file changed, 1 insertion(+), 1 deletion(-) diff --git a/moses/metrics/utils.py b/moses/metrics/utils.py index a821b94..b4304bb 100644 --- a/moses/metrics/utils.py +++ b/moses/metrics/utils.py @@ -21,7 +21,7 @@ _pains = pd.read_csv(os.path.join(_base_dir, 'wehi_pains.csv'), names=['smarts', 'names']) _filters = [Chem.MolFromSmarts(x) for x in - _mcf.append(_pains, sort=True)['smarts'].values] + _mcf._append(_pains, sort=True)['smarts'].values] def canonic_smiles(smiles_or_mol):