ctest gfortran UNRES_M_multi_min

diff --git a/ctest/prota_unres_energy_check_mult.sh b/ctest/prota_unres_energy_check_mult.sh
index bc61564..be06f68 100755 (executable)
--- a/ctest/prota_unres_energy_check_mult.sh
+++ b/ctest/prota_unres_energy_check_mult.sh
@@ -151,7 +151,7 @@ elif [ "$1" == "1DKZcut-lang" ]; then
 elif [ "$1" == "1DKZcut-min" ]; then
  extremediff="10.0"                    # extreme energy difference, comething went terribly wrong
  expectenergy="323.6931"               # - expected total energy
- cutoffdiff="6.0"                      # energy cutoff variation - more then this rises warning  
+ cutoffdiff="8.0"                      # energy cutoff variation - more then this rises warning  
  
  sumsl_return=`grep SUMSL $file|awk '{print $4}'`
  echo 'SUMSL return code' $sumsl_return