Activate QMMM MDModule
[alexxy/gromacs.git] / src / gromacs / gmxpreprocess / tests / refdata / GetIrTest_AcceptsEmptyLines.xml
index 72c39c0c0e3ea041031f2ce4b466e8babfc3c0db..2f3bebf7c10abb1bda56a7251e9b46c402143a12 100644 (file)
@@ -298,5 +298,8 @@ electric-field-z         = 0 0 0 0
 
 ; Density guided simulation
 density-guided-simulation-active = false
+
+; QM/MM with CP2K
+qmmm-cp2k-active         = false
 </String>
 </ReferenceData>