respa now working without dfa weights

[unres.git] / source / unres / src_MD / energy_split-sep.F

diff --git a/source/unres/src_MD/energy_split-sep.F b/source/unres/src_MD/energy_split-sep.F
index 97442a3..f40b7af 100644 (file)
--- a/source/unres/src_MD/energy_split-sep.F
+++ b/source/unres/src_MD/energy_split-sep.F
@@ -398,13 +398,29 @@ C
   107 continue
 
 C     BARTEK for dfa test!
-      if (wdfa_dist.gt.0) call edfad(edfadis)
+      if (wdfa_dist.gt.0) then 
+         call edfad(edfadis)
+      else
+         edfadis=0.0
+      endif
 c      print*, 'edfad is finished!', edfadis
-      if (wdfa_tor.gt.0) call edfat(edfator)
+      if (wdfa_tor.gt.0) then 
+         call edfat(edfator)
+      else
+         edfator=0.0
+      endif
 c      print*, 'edfat is finished!', edfator
-      if (wdfa_nei.gt.0) call edfan(edfanei)
+      if (wdfa_nei.gt.0) then 
+         call edfan(edfanei)
+      else
+         edfanei=0.0
+      endif
 c      print*, 'edfan is finished!', edfanei
-      if (wdfa_beta.gt.0) call edfab(edfabet)
+      if (wdfa_beta.gt.0) then 
+         call edfab(edfabet)
+      else
+         edfabet=0.0
+      endif
 c      print*, 'edfab is finished!', edfabet
 c
 c Calculate the short-range part of Evdwpp