X-Git-Url: http://mmka.chem.univ.gda.pl/gitweb/?a=blobdiff_plain;ds=inline;f=source%2Funres%2Fsrc_MD%2Finitialize_p.F;h=3850030dc99d0227959db25f1a5c6312bd58ee92;hb=ee63e3c2690474ee368e6d7c6fd51dabec6a5406;hp=565ccaf0bfef32d8fc44bb2ecb11eda6a3e675bc;hpb=72c621b321f2cd9b04aba5ef69660e89f974b530;p=unres.git

diff --git a/source/unres/src_MD/initialize_p.F b/source/unres/src_MD/initialize_p.F
index 565ccaf..3850030 100644
--- a/source/unres/src_MD/initialize_p.F
+++ b/source/unres/src_MD/initialize_p.F
@@ -164,8 +164,12 @@ c      call memmon_print_usage()
 	rr0(i)=0.0D0
 	a0thet(i)=0.0D0
 	do j=1,2
-	  athet(j,i)=0.0D0
-	  bthet(j,i)=0.0D0
+         do k=-1,1
+         do kk=-1,1
+          athet(j,i,k,kk)=0.0D0
+	  bthet(j,i,k,kk)=0.0D0
+         enddo
+         enddo
         enddo
 	do j=0,3
 	  polthet(j,i)=0.0D0
@@ -191,15 +195,17 @@ c      call memmon_print_usage()
       enddo
       nlob(ntyp1)=0
       dsc(ntyp1)=0.0D0
+      do iblock=1,2
       do i=1,maxtor
 	itortyp(i)=0
 	do j=1,maxtor
 	  do k=1,maxterm
-	    v1(k,j,i)=0.0D0
-	    v2(k,j,i)=0.0D0
+	    v1(k,j,i,iblock)=0.0D0
+	    v2(k,j,i,iblock)=0.0D0
           enddo
         enddo
       enddo
+      enddo
       do i=1,maxres
 	itype(i)=0
 	itel(i)=0