X-Git-Url: http://mmka.chem.univ.gda.pl/gitweb/?a=blobdiff_plain;f=ctest%2Fdock_newcorr%2Fwham_check.sh;h=9549787d0451dd1151766c22fd5c94798b179bfb;hb=223f8f78286188a4cdf1b4d0b05205adc9b22912;hp=bdd5445c81be81fba7f65a4792afcb45313212fb;hpb=c2dd27cc9bb81bf584cd33ed081642fa8ff0f582;p=unres.git

diff --git a/ctest/dock_newcorr/wham_check.sh b/ctest/dock_newcorr/wham_check.sh
index bdd5445..9549787 100755
--- a/ctest/dock_newcorr/wham_check.sh
+++ b/ctest/dock_newcorr/wham_check.sh
@@ -25,13 +25,13 @@ echo 'average rms for T<280 ' $rms
   error=1
  fi
 
- if [ `echo "a=$max-268;if(0>a)a*=-1;a>10.0"|bc -l` != "0" ]; then
-  echo 'ERROR wrong T max of Cv(T) by more than 10 K'
+ if [ `echo "a=$max-206;if(0>a)a*=-1;a>100.0"|bc -l` != "0" ]; then
+  echo 'ERROR wrong T max of Cv(T) by more than 100 K'
   error=1
  fi
 
- if [ `echo "a=$rms-2.2;if(0>a)a*=-1;a>0.2"|bc -l` != "0" ]; then
-  echo 'ERROR wrong average rms for T<280 by more than 0.2'
+ if [ `echo "a=$rms-9.7;if(0>a)a*=-1;a>2.0"|bc -l` != "0" ]; then
+  echo 'ERROR wrong average rms for T<280 by more than 2.0'
   error=1
  fi