ctest NEWCORR ref values

[unres.git] / ctest / 1DKZcut-checkgrad.inp

diff --git a/ctest/1DKZcut-checkgrad.inp b/ctest/1DKZcut-checkgrad.inp
index 80e7a46..0d1c9b8 100644 (file)
--- a/ctest/1DKZcut-checkgrad.inp
+++ b/ctest/1DKZcut-checkgrad.inp
@@ -1,5 +1,6 @@
 multichain energy test
-SEED=-3059743 PDBSTART REFSTR PDBREF PDBOUT DISTCHAINMAX=100 checkgrad cart
+SEED=-3059743 PDBSTART REFSTR PDBREF PDBOUT DISTCHAINMAX=100 checkgrad cart    &
+delta=1.0e-4
 WLONG=1.00000 WSCP=1.23315 WELEC=0.84476 WBOND=1.00000 WANG=0.62954            &
 WSCLOC=0.10554 WTOR=1.34316 WTORD=1.26571 WCORRH=0.19212 WCORR5=0.00000        &
 WCORR6=0.00000 WEL_LOC=0.37357 WTURN3=1.40323 WTURN4=0.64673 WTURN6=0.00000    &