From: Cezary Czaplewski <czarek@chem.univ.gda.pl>
Date: Sun, 5 Apr 2020 08:04:51 +0000 (+0200)
Subject: ctest ref 1DKZcut-min
X-Git-Url: http://mmka.chem.univ.gda.pl/gitweb/?p=unres.git;a=commitdiff_plain;h=c46050d45363648da9c11246030db4b038ad4aa8

ctest ref 1DKZcut-min
---

diff --git a/ctest/newcorr/prota_unres_energy_check_mult.sh b/ctest/newcorr/prota_unres_energy_check_mult.sh
index 66b2536..b47ae04 100755
--- a/ctest/newcorr/prota_unres_energy_check_mult.sh
+++ b/ctest/newcorr/prota_unres_energy_check_mult.sh
@@ -154,8 +154,8 @@ elif [ "$1" == "1DKZcut-lang" ]; then
 
 elif [ "$1" == "1DKZcut-min" ]; then
  extremediff="10.0"			# extreme energy difference, comething went terribly wrong
- expectenergy="-108.0871"		# - expected total energy
- cutoffdiff="8.0"			# energy cutoff variation - more then this rises warning  
+ expectenergy="-154.36"		# - expected total energy
+ cutoffdiff="10.0"			# energy cutoff variation - more then this rises warning  
  
  sumsl_return=`grep SUMSL $file|awk '{print $4}'`
  echo 'SUMSL return code' $sumsl_return