Add gapsys softcore function.
[alexxy/gromacs.git] / src / gromacs / gmxpreprocess / tests / refdata / GetIrTest_AcceptsDefineParametersWithValuesIncludingAssignment.xml
index c88c2aa7928a82785c179cfeff34f872892ba3e5..62fa19cdb9ba8588614c9ac25438ae2462d08faf 100644 (file)
@@ -254,6 +254,7 @@ sc-power                 = 1
 sc-r-power               = 6
 sc-sigma                 = 0.3
 sc-coul                  = no
+sc-function              = beutler
 separate-dhdl-file       = yes
 dhdl-derivatives         = yes
 dh_hist_size             = 0