Add virtual site with one constructing atom

[alexxy/gromacs.git] / src / gromacs / gmxlib / nrnb.cpp

diff --git a/src/gromacs/gmxlib/nrnb.cpp b/src/gromacs/gmxlib/nrnb.cpp
index 1fca45d7cddb063fb7e15a2a27810514ac6dcfa5..1366d351e51c93f6abbec57f2234fd6300bea1e5 100644 (file)
--- a/src/gromacs/gmxlib/nrnb.cpp
+++ b/src/gromacs/gmxlib/nrnb.cpp
@@ -175,6 +175,7 @@ static const t_nrnb_data nbdata[eNRNB] = {
     { "Shake-Init", 10 },
     { "Constraint-Vir", 24 },
     { "Settle", 370 },
+    { "Virtual Site 1", 1 },
     { "Virtual Site 2", 23 },
     { "Virtual Site 2fd", 63 },
     { "Virtual Site 3", 37 },