From c5dd730856e0d506a8ca03ec985d9addcbc6589c Mon Sep 17 00:00:00 2001
From: Xavier Robin <xavier.robin@unibas.ch>
Date: Tue, 19 Sep 2023 11:33:02 +0200
Subject: [PATCH] test: fix invalid entity view.
Not sure why this doesn't cause an error here, but the code is invalid.
---
modules/mol/alg/tests/test_ligand_scoring.py | 6 ++++--
1 file changed, 4 insertions(+), 2 deletions(-)
diff --git a/modules/mol/alg/tests/test_ligand_scoring.py b/modules/mol/alg/tests/test_ligand_scoring.py
index 3896aa2fd..65249c2b5 100644
--- a/modules/mol/alg/tests/test_ligand_scoring.py
+++ b/modules/mol/alg/tests/test_ligand_scoring.py
@@ -196,8 +196,10 @@ class TestLigandScoring(unittest.TestCase):
# Test that it works with views and only consider atoms in the view
# Skip PA, PB and O[1-3]A and O[1-3]B in target and model
# We assume atom index are fixed and won't change
- trg_g3d1_sub = trg_g3d1.Select("aindex>6019").residues[0]
- mdl_g3d_sub = mdl_g3d.Select("aindex>1447").residues[0]
+ trg_g3d1_sub_ent = trg_g3d1.Select("aindex>6019")
+ trg_g3d1_sub = trg_g3d1_sub_ent.residues[0]
+ mdl_g3d_sub_ent = mdl_g3d.Select("aindex>1447")
+ mdl_g3d_sub = mdl_g3d_sub_ent.residues[0]
sym = ligand_scoring._ComputeSymmetries(mdl_g3d_sub, trg_g3d1_sub)
assert len(sym) == 6
--
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