From ddebeb9a97465df208a4c5e9e150cbc2e308f08f Mon Sep 17 00:00:00 2001
From: Gabriel Studer <gabriel.studer@unibas.ch>
Date: Wed, 6 Jul 2022 16:57:18 +0200
Subject: [PATCH] lDDT: bugfix
---
modules/mol/alg/pymod/lddt.py | 1 +
1 file changed, 1 insertion(+)
diff --git a/modules/mol/alg/pymod/lddt.py b/modules/mol/alg/pymod/lddt.py
index 95a9a5af0..91419c91e 100644
--- a/modules/mol/alg/pymod/lddt.py
+++ b/modules/mol/alg/pymod/lddt.py
@@ -487,6 +487,7 @@ class lDDTScorer:
for ch in model.chains:
model_ch_name = ch.GetName()
if model_ch_name not in chain_mapping:
+ current_model_res_idx += len(ch.residues)
continue # additional model chain which is not mapped
target_ch_name = chain_mapping[model_ch_name]
--
GitLab