Merge branch 'devel' into feature-ga

[unres.git] / source / unres / src_MD / src / md-diff / md / sd_verlet2.f

diff --git a/source/unres/src_MD/src/md-diff/md/sd_verlet2.f b/source/unres/src_MD/src/md-diff/md/sd_verlet2.f
deleted file mode 100644 (file)
index c8472fb..0000000
--- a/source/unres/src_MD/src/md-diff/md/sd_verlet2.f
+++ /dev/null
@@ -1,54 +0,0 @@
-c--------------------------------------------------------------------------
-      subroutine sd_verlet2
-c  Calculating the adjusted velocities for accelerations
-      implicit real*8 (a-h,o-z)
-      include 'DIMENSIONS'
-      include 'COMMON.CONTROL'
-      include 'COMMON.VAR'
-      include 'COMMON.MD'
-      include 'COMMON.LANGEVIN'
-      include 'COMMON.CHAIN'
-      include 'COMMON.DERIV'
-      include 'COMMON.GEO'
-      include 'COMMON.LOCAL'
-      include 'COMMON.INTERACT'
-      include 'COMMON.IOUNITS'
-      include 'COMMON.NAMES'
-      double precision stochforcvec(MAXRES6),stochforcvecV(MAXRES6)
-      common /stochcalc/ stochforcvec
-c
-c Compute the stochastic forces which contribute to velocity change
-c
-      call stochastic_force(stochforcvecV)
-
-      do i=1,dimen
-        ddt1=0.0d0
-        ddt2=0.0d0
-        do j=1,dimen
-          ddt1=ddt1+vfric_mat(i,j)*d_a_work(j)
-          ddt2=ddt2+vrand_mat1(i,j)*stochforcvec(j)+
-     &     vrand_mat2(i,j)*stochforcvecV(j)
-        enddo
-        d_t_work(i)=d_t_work_new(i)+0.5d0*ddt1+ddt2
-      enddo
-      do j=1,3
-        d_t(j,0)=d_t_work(j)
-      enddo
-      ind=3
-      do i=nnt,nct-1
-        do j=1,3
-          d_t(j,i)=d_t_work(ind+j)
-        enddo
-        ind=ind+3
-      enddo
-      do i=nnt,nct
-        if (itype(i).ne.10) then
-          inres=i+nres
-          do j=1,3
-            d_t(j,inres)=d_t_work(ind+j)
-          enddo
-          ind=ind+3
-        endif
-      enddo 
-      return
-      end