X-Git-Url: http://mmka.chem.univ.gda.pl/gitweb/?a=blobdiff_plain;f=ctest%2Fdock%2Fwham_check.sh;h=3b295925a040bc9a69b1b2e15989ca8803059457;hb=95cc80884174e2d4316e46f0fb50a061a1e20f76;hp=1cb888cb8ea7a78bc28aa2ae8b3b226a9102952c;hpb=2a549b9e12596252a8186a01a8d8939b7efe1111;p=unres.git

diff --git a/ctest/dock/wham_check.sh b/ctest/dock/wham_check.sh
index 1cb888c..3b29592 100755
--- a/ctest/dock/wham_check.sh
+++ b/ctest/dock/wham_check.sh
@@ -25,13 +25,13 @@ echo 'average rms for T<280 ' $rms
   error=1
  fi
 
- if [ `echo "a=$max-293;if(0>a)a*=-1;a>10.0"|bc -l` != "0" ]; then
-  echo 'ERROR wrong T max of Cv(T) by more than 10 K'
+ if [ `echo "a=$max-290;if(0>a)a*=-1;a>50.0"|bc -l` != "0" ]; then
+  echo 'ERROR wrong T max of Cv(T) by more than 50 K'
   error=1
  fi
 
- if [ `echo "a=$rms-9.3;if(0>a)a*=-1;a>0.2"|bc -l` != "0" ]; then
-  echo 'ERROR wrong average rms for T<280 by more than 0.2'
+ if [ `echo "a=$rms-8.5;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