diff --git a/modules/mol/alg/pymod/ligand_scoring.py b/modules/mol/alg/pymod/ligand_scoring.py index 8297772d54c52544a23dc2337abf64af6e910353..6b567c358bcc48c1d3353e0e955f49a80722dc21 100644 --- a/modules/mol/alg/pymod/ligand_scoring.py +++ b/modules/mol/alg/pymod/ligand_scoring.py @@ -700,7 +700,7 @@ class LigandScorer: mat2 = np.copy(mat1) mat2[~np.isnan(mat2)] = np.inf else: - mat2 = np.copy(mat1) + mat2 = np.copy(mat2) assignments = [] min_mat1 = LigandScorer._nanmin_nowarn(mat1) while not np.isnan(min_mat1):