From efa10e784c4caa0f70fbbe4a6e0890f711d7441d Mon Sep 17 00:00:00 2001
From: Gerardo Tauriello <gerardo.tauriello@unibas.ch>
Date: Wed, 18 Jul 2018 15:09:23 +0200
Subject: [PATCH] Remove extensive mapping restriction for CASP13 use.
---
modules/mol/alg/pymod/qsscoring.py | 4 ++--
1 file changed, 2 insertions(+), 2 deletions(-)
diff --git a/modules/mol/alg/pymod/qsscoring.py b/modules/mol/alg/pymod/qsscoring.py
index 228fbb432..8339bf2fa 100644
--- a/modules/mol/alg/pymod/qsscoring.py
+++ b/modules/mol/alg/pymod/qsscoring.py
@@ -1861,8 +1861,8 @@ def _GetChainMapping(ent_1, ent_2, symm_1, symm_2, chem_mapping):
LogInfo('Inter Symmetry-group mappings to check: %s' \
% count['inter']['mappings'])
nr_mapp = count['intra']['mappings'] + count['inter']['mappings']
- if nr_mapp > 100000: # 322560 is octamer vs octamer
- raise QSscoreError('Too many possible mappings: %s' % nr_mapp)
+ # if nr_mapp > 100000: # 322560 is octamer vs octamer
+ # raise QSscoreError('Too many possible mappings: %s' % nr_mapp)
# to speed up the computations we cache chain views and RMSDs
cached_rmsd = _CachedRMSD(ent_1, ent_2)
--
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