ctest dfa

[unres.git] / ctest / dfa / checkgrad_dfa.inp

diff --git a/ctest/dfa/checkgrad_dfa.inp b/ctest/dfa/checkgrad_dfa.inp
index 31789a3..d9cd09d 100644 (file)
--- a/ctest/dfa/checkgrad_dfa.inp
+++ b/ctest/dfa/checkgrad_dfa.inp
@@ -1,6 +1,6 @@
 dfa checkgrad cart
 SEED=-3059743 rescale_mode=2 one_letter PDBSTART timlim=2800.0                 &
-CONSTR_HOMOL=8 PDBREF REFSTR checkgrad cart
+CONSTR_HOMOL=8 PDBREF REFSTR 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    &