nano part 3

[unres.git] / source / unres / src_MD-M / COMMON.INTERACT

diff --git a/source/unres/src_MD-M/COMMON.INTERACT b/source/unres/src_MD-M/COMMON.INTERACT
index 14d92ef..f94a51b 100644 (file)
--- a/source/unres/src_MD-M/COMMON.INTERACT
+++ b/source/unres/src_MD-M/COMMON.INTERACT
@@ -1,7 +1,11 @@
       double precision aa,bb,augm,aad,bad,app,bpp,ale6,ael3,ael6,
      &aa_lip,bb_lip,aa_aq,bb_aq,sc_aa_tube_par,sc_bb_tube_par,
-     & pep_aa_tube,pep_bb_tube
-
+     & pep_aa_tube,pep_bb_tube,dcavtub,acavtub,bcavtub,ccavtub
+      double precision wdti,wdti2,wdti4,wdti8,
+     &                 wdtii,wdtii2,wdtii4,wdtii8 
+      common /nosehoover_dt/
+     &   wdti(maxyosh),wdti2(maxyosh),wdti4(maxyosh),wdti8(maxyosh),
+     &   wdtii(maxyosh),wdtii2(maxyosh),wdtii4(maxyosh),wdtii8(maxyosh)
       integer expon,expon2
       integer nnt,nct,nint_gr,istart,iend,itype,itel,itypro,
      & ielstart,ielend,ielstart_vdw,ielend_vdw,nscp_gr,iscpstart,
@@ -11,7 +15,8 @@
       common /interact/aa_aq(ntyp,ntyp),bb_aq(ntyp,ntyp),
      & aa_lip(ntyp,ntyp),bb_lip(ntyp,ntyp),
      & sc_aa_tube_par(ntyp),sc_bb_tube_par(ntyp),
-     & pep_aa_tube,pep_bb_tube,
+     & pep_aa_tube,pep_bb_tube,acavtub(ntyp),dcavtub(ntyp),
+     & bcavtub(ntyp),ccavtub(ntyp),
      & augm(ntyp,ntyp),
      & aad(ntyp,2),bad(ntyp,2),app(2,2),bpp(2,2),ael6(2,2),ael3(2,2),
      & expon,expon2,nnt,nct,nint_gr(maxres),istart(maxres,maxint_gr),