From: Cezary Czaplewski Date: Sun, 22 Mar 2020 20:44:49 +0000 (+0100) Subject: ctest dock wham ref max Cv X-Git-Url: http://mmka.chem.univ.gda.pl/gitweb/?p=unres.git;a=commitdiff_plain;h=ec9c93770c9e77ea31d2832f8598e3dbdac629d6 ctest dock wham ref max Cv --- diff --git a/ctest/dock_newcorr/wham_check.sh b/ctest/dock_newcorr/wham_check.sh index 71b18a6..d7fee40 100755 --- a/ctest/dock_newcorr/wham_check.sh +++ b/ctest/dock_newcorr/wham_check.sh @@ -25,7 +25,7 @@ echo 'average rms for T<280 ' $rms error=1 fi - if [ `echo "a=$max-270;if(0>a)a*=-1;a>50.0"|bc -l` != "0" ]; then + if [ `echo "a=$max-216;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