X-Git-Url: http://mmka.chem.univ.gda.pl/gitweb/?a=blobdiff_plain;f=ctest%2Fnewcorr%2Fprota_unres_energy_check_mult.sh;h=470594fa5ff591f78a949dcf0da5cb1b73408930;hb=75e702f7dc466298767c26ebd4ad200203dd5008;hp=e415b57b419d4b84ef9f5e1e8f358056ef8869e2;hpb=2669accd115e795eccd5ed16ca99da0c0a07e3a4;p=unres.git diff --git a/ctest/newcorr/prota_unres_energy_check_mult.sh b/ctest/newcorr/prota_unres_energy_check_mult.sh index e415b57..470594f 100755 --- a/ctest/newcorr/prota_unres_energy_check_mult.sh +++ b/ctest/newcorr/prota_unres_energy_check_mult.sh @@ -320,7 +320,7 @@ if [ $true1 -eq 1 ]; then fi # Check if Energy value is as expected -true2=`awk "BEGIN{print $absdiff >= $extremediff}"` +true2=`awk "BEGIN{print $absdiff <= $cutoffdiff}"` if [ $true2 -eq 1 ]; then echo "OK: absdiff= $absdiff, ene= $myene" exit 0