Trisurf Monte Carlo simulator
Samo Penic
2013-11-24 84af719f37b54185ddd7daf0627421143874905c
src/timestep.c
@@ -1,472 +1,123 @@
#include<stdlib.h>
#include<math.h>
#include "general.h"
#include "vertex.h"
#include "bond.h"
#include "triangle.h"
#include "vesicle.h"
#include "energy.h"
#include "timestep.h"
#include "cell.h"
//#include "io.h"
#include<stdio.h>
#include<math.h>
#include<pthread.h>
//#include<unistd.h> //usleep requires it
//#include "io.h"
#include "general.h"
#include "timestep.h"
#include "vertexmove.h"
#include "bondflip.h"
#include "frame.h"
#include "vertex.h"
#include "io.h"
ts_bool single_timestep(ts_vesicle *vesicle){
    ts_bool retval;
ts_bool run_simulation(ts_vesicle *vesicle, ts_uint mcsweeps, ts_uint inititer, ts_uint iterations){
   ts_uint i, j,k ;
   centermass(vesicle);
   cell_occupation(vesicle);
   ts_fprintf(stdout, "Starting simulation (first %d x %d MC sweeps will not be recorded on disk)\n", inititer, mcsweeps);
   ts_fprintf(stdout, "Starting %d threads\n",vesicle->threads);
   pthread_t *tid=(pthread_t *)malloc(sizeof(pthread_t)*vesicle->threads);
   thdata *data=(thdata *)malloc(sizeof(thdata)*vesicle->threads);
   pthread_mutex_init(&(vesicle->mutex->vtx_taint),NULL);
   pthread_mutex_init(&(vesicle->mutex->vtx_untaint),NULL);
   pthread_mutex_init(&(vesicle->mutex->cell_modify),NULL);
   for(i=0;i<vesicle->threads;i++){
      data[i].thread_no=i;
      data[i].vesicle=vesicle;
      data[i].threads=vesicle->threads;
   }
    for(i=0;i<inititer+iterations;i++){
      for(j=0;j<mcsweeps;j++){
         for(k=0;k<vesicle->threads;k++){
            pthread_create(&tid[k], NULL, single_timestep, (void *)&data[k]);
         }
         for(k=0;k<vesicle->threads;k++){
                 pthread_join(tid[k],NULL);
         }
      //   single_timestep(vesicle);
      }
      centermass(vesicle);
      cell_occupation(vesicle);
      if(i>inititer){
         write_vertex_xml_file(vesicle,i-inititer);
      }
   }
   pthread_mutex_destroy(&(vesicle->mutex->vtx_taint));
   pthread_mutex_destroy(&(vesicle->mutex->vtx_untaint));
   pthread_exit(NULL);
   return TS_SUCCESS;
}
void * single_timestep(void *thread_data){
   thdata *data;
   data=(thdata *)thread_data;
   ts_vesicle *vesicle=data->vesicle;
   ts_uint thID=data->thread_no;
   ts_uint partition_size=(ts_uint)(vesicle->vlist->n/data->threads);
   ts_uint end;
   if(thID==data->threads-1){
      end=vesicle->vlist->n;
   } else {
      end=(thID+1)*partition_size;
   }
    ts_double rnvec[3];
    ts_uint i;
    for(i=0;i<vesicle->vlist.n;i++){
    ts_uint i,j; //b;
//   ts_fprintf(stdout,"Thread thID=%d report for duty. My vtxes are in range from %d to %d.\n",thID,thID*partition_size, end-1);
    for(i=thID*partition_size;i<end;i++){
        rnvec[0]=drand48();
        rnvec[1]=drand48();
        rnvec[2]=drand48();
        retval=single_verticle_timestep(vesicle,&vesicle->vlist.vertex[i],rnvec);
//TODO: you only need to taint (lock) vertices, that could be shared with another partition. You can leave out the rest. How can you test for that? Well, if any of vtx neighbours are in other partition, then you need to lock vertex and that neighbor. Otherwise not!
   /**** THREAD IS POTENTIALLY LOCKED ******/
   pthread_mutex_lock(&vesicle->mutex->vtx_taint); //taint if no other process is tainting or wait until you can taint
   //   ts_fprintf(stdout, "thID=%d:: Tainting vertex %d, level=%d. Waiting....\n",thID, i, vesicle->vlist->vtx[i]->locked);
   while(vertex_tainted(vesicle->vlist->vtx[i],1,1)){
      ts_fprintf(stdout, "thID=%d:: Vertex %d is tainted, so I cannot try vertexmove. Amount=%d. BU(H)TELJ!\n       neigh. vtxs: ",thID, i, vesicle->vlist->vtx[i]->locked);
      for(j=0; j<vesicle->vlist->vtx[i]->neigh_no; j++){
         ts_fprintf(stdout, "%d(a=%d) ", vesicle->vlist->vtx[i]->neigh[j]->idx,  vesicle->vlist->vtx[i]->neigh[j]->locked);
      }
      ts_fprintf(stdout, ".\n");
   }
   pthread_mutex_lock(&vesicle->mutex->vtx_untaint);
   vertex_taint(vesicle->vlist->vtx[i],1);
   pthread_mutex_unlock(&vesicle->mutex->vtx_untaint);
   pthread_mutex_unlock(&vesicle->mutex->vtx_taint);
   /**** THREAD IS RELEASING MUTEX RESOURCES ******/
        single_verticle_timestep(vesicle,vesicle->vlist->vtx[i],rnvec);
   pthread_mutex_lock(&vesicle->mutex->vtx_untaint);
   vertex_untaint(vesicle->vlist->vtx[i],1);
   pthread_mutex_unlock(&vesicle->mutex->vtx_untaint);
//      ts_fprintf(stdout, "Vertex %d should be untainted, level=%d.\n", i, vesicle->vlist->vtx[i]->locked);
    }
    for(i=0;i<vesicle->blist.n;i++){
        rnvec[0]=drand48();
        rnvec[1]=drand48();
        rnvec[2]=drand48();
//   ts_int cnt=0;
/*
    for(i=0;i<vesicle->vlist->n;i++){
   b=rand() % vesicle->blist->n;
        //find a bond and return a pointer to a bond...
        //call single_bondflip_timestep...
        retval=single_bondflip_timestep(vesicle,&vesicle->blist.bond[i],rnvec);
        retval=single_bondflip_timestep(vesicle,vesicle->blist->bond[b],rnvec);
//   if(retval==TS_SUCCESS) cnt++;
    } 
//   printf("Bondflip success rate in one sweep: %d/%d=%e\n", cnt,vesicle->blist->n,(double)cnt/(double)vesicle->blist->n);
*/
/*   if(retval);
    return TS_SUCCESS;
}
ts_bool single_verticle_timestep(ts_vesicle *vesicle,ts_vertex *vtx,ts_double
*rn){
    ts_uint i;
    ts_double dist;
    ts_vertex tvtx;
    ts_bool retval;
    ts_uint cellidx;
    ts_double xold,yold,zold;
    ts_double delta_energy,oenergy;
    ts_vertex *ovtx;
    //randomly we move the temporary vertex
    tvtx.x=vtx->x+vesicle->stepsize*(2.0*rn[0]-1.0);
    tvtx.y=vtx->y+vesicle->stepsize*(2.0*rn[1]-1.0);
    tvtx.z=vtx->z+vesicle->stepsize*(2.0*rn[2]-1.0);
    //check we if some length to neighbours are too much
    for(i=0;i<vtx->neigh_no;i++){
        dist=vertex_distance_sq(&tvtx,vtx->neigh[i]);
        if(dist<1.0 || dist>vesicle->dmax) return TS_FAIL;
    }
    //self avoidance check with distant vertices
     cellidx=vertex_self_avoidance(vesicle, &tvtx);
    //check occupation number
     retval=cell_occupation_number_and_internal_proximity(&vesicle->clist,cellidx,vtx,&tvtx);
    if(retval==TS_FAIL){
        return TS_FAIL;
    }
    //if all the tests are successful, then we update the vertex position
    xold=vtx->x;
    yold=vtx->y;
    zold=vtx->z;
    ovtx=malloc(sizeof(ts_vertex));
    vertex_full_copy(ovtx,vtx);
    vtx->x=tvtx.x;
    vtx->y=tvtx.y;
    vtx->z=tvtx.z;
    delta_energy=0;
    //update the normals of triangles that share bead i.
    for(i=0;i<vtx->tristar_no;i++) triangle_normal_vector(vtx->tristar[i]);
    //energy and curvature
    energy_vertex(vtx);
    delta_energy=vtx->xk*(vtx->energy - ovtx->energy);
    //the same is done for neighbouring vertices
    for(i=0;i<vtx->neigh_no;i++){
        oenergy=vtx->neigh[i]->energy;
        energy_vertex(vtx->neigh[i]);
        delta_energy+=vtx->neigh[i]->xk*(vtx->neigh[i]->energy-oenergy);
    }
  //  fprintf(stderr, "DE=%f\n",delta_energy);
    //MONTE CARLOOOOOOOO
    if(delta_energy>=0){
#ifdef TS_DOUBLE_DOUBLE
        if(exp(-delta_energy)< drand48() )
#endif
#ifdef TS_DOUBLE_FLOAT
        if(expf(-delta_energy)< (ts_float)drand48())
#endif
#ifdef TS_DOUBLE_LONGDOUBLE
        if(expl(-delta_energy)< (ts_ldouble)drand48())
#endif
    {
    //not accepted, reverting changes
    vtx->x=xold;
    vtx->y=yold;
    vtx->z=zold;
    //update the normals of triangles that share bead i.
    for(i=0;i<vtx->tristar_no;i++) triangle_normal_vector(vtx->tristar[i]);
    //energy and curvature
    energy_vertex(vtx);
    //the same is done for neighbouring vertices
    for(i=0;i<vtx->neigh_no;i++) energy_vertex(vtx->neigh[i]);
  free(ovtx->bond_length);
    free(ovtx->bond_length_dual);
    free(ovtx);
    return TS_FAIL;
    }
}
    //END MONTE CARLOOOOOOO
    //TODO: change cell occupation if necessary!
    free(ovtx->bond_length);
    free(ovtx->bond_length_dual);
    free(ovtx);
    return TS_SUCCESS;
}
ts_bool single_bondflip_timestep(ts_vesicle *vesicle, ts_bond *bond, ts_double *rn){
/*c  Vertex and triangle (lm and lp) indexing for bond flip:
c      +----- k-------+              +----- k ------+
c      |lm1 / | \ lp1 |              |lm1 /   \ lp1 |
c      |  /   |   \   |              |  /       \   |
c      |/     |     \ |     FLIP     |/    lm     \ |
c     km  lm  | lp   kp    --->      km ---------- kp
c      |\     |     / |              |\    lp     / |
c      |  \   |   /   |              |  \       /   |
c      |lm2 \ | / lp2 |              |lm2 \   / lp2 |
c      +------it------+              +----- it -----+
c
*/
    ts_vertex *it=bond->vtx1;
    ts_vertex *k=bond->vtx2;
    ts_uint nei,neip,neim;
    ts_uint i,j;
    ts_double oldenergy, delta_energy;
 //   ts_triangle *lm=NULL,*lp=NULL, *lp1=NULL, *lp2=NULL, *lm1=NULL, *lm2=NULL;
    ts_vertex *kp,*km;
    if(it->neigh_no< 3) return TS_FAIL;
    if(k->neigh_no< 3) return TS_FAIL;
    if(k==NULL || it==NULL){
        fatal("In bondflip, number of neighbours of k or it is less than 3!",999);
    }
    for(i=0;i<it->neigh_no;i++){ // Finds the nn of it, that is k
        if(it->neigh[i]==k){
            nei=i;
            break;
        }
    }
    neip=nei+1;  // I don't like it.. Smells like I must have it in correct order
    neim=nei-1;
    if(neip>=it->neigh_no) neip=0;
    if((ts_int)neim<0) neim=it->neigh_no-1; /* casting is essential... If not
there the neim is never <0 !!! */
  //  fprintf(stderr,"The numbers are: %u %u\n",neip, neim);
    km=it->neigh[neim];  // We located km and kp
    kp=it->neigh[neip];
    if(km==NULL || kp==NULL){
        fatal("In bondflip, cannot determine km and kp!",999);
    }
  //  fprintf(stderr,"I WAS HERE! after the 4 vertices are known!\n");
/* test if the membrane is wrapped too much, so that kp is nearest neighbour of
 * km. If it is true, then don't flip! */
    for(i=0;i<km->neigh_no;i++){
        if(km->neigh[i] == kp) return TS_FAIL;
    }
 //   fprintf(stderr,"Membrane didn't wrap too much.. Continue.\n");
/* if bond would be too long, return... */
    if(vertex_distance_sq(km,kp) > vesicle->dmax ) return TS_FAIL;
 //   fprintf(stderr,"Bond will not be too long.. Continue.\n");
/* we make a bond flip. this is different than in original fortran */
// 0. step. Get memory prior the flip
  oldenergy=0;
  oldenergy+=k->xk* k->energy;
  oldenergy+=kp->xk* kp->energy;
  oldenergy+=km->xk* km->energy;
  oldenergy+=it->xk* it->energy;
//  for(i=0;i<k->neigh_no;i++) oldenergy+=k->neigh[i]->xk*k->neigh[i]->energy;
//  for(i=0;i<kp->neigh_no;i++) oldenergy+=kp->neigh[i]->xk*kp->neigh[i]->energy;
//  for(i=0;i<km->neigh_no;i++) oldenergy+=km->neigh[i]->xk*km->neigh[i]->energy;
//  for(i=0;i<it->neigh_no;i++) oldenergy+=it->neigh[i]->xk*it->neigh[i]->energy;
/*
fprintf(stderr,"*** Naslov k=%d\n",k);
fprintf(stderr,"*** Naslov it=%d\n",it);
fprintf(stderr,"*** Naslov km=%d\n",km);
fprintf(stderr,"*** Naslov kp=%d\n",kp);
for(i=0;i<k->neigh_no;i++)
    fprintf(stderr,"k sosed=%d\n",k->neigh[i]);
for(i=0;i<it->neigh_no;i++)
    fprintf(stderr,"it sosed=%d\n",it->neigh[i]);
for(i=0;i<km->neigh_no;i++)
    fprintf(stderr,"km sosed=%d\n",km->neigh[i]);
for(i=0;i<kp->neigh_no;i++)
    fprintf(stderr,"kp sosed=%d\n",kp->neigh[i]);
*/
  //  fprintf(stderr,"I WAS HERE! Before bondflip!\n");
    ts_flip_bond(k,it,km,kp, bond);
   // fprintf(stderr,"I WAS HERE! Bondflip successful!\n");
/* Calculating the new energy */
  delta_energy=0;
  for(i=0;i<k->neigh_no;i++) energy_vertex(k->neigh[i]);
  for(i=0;i<kp->neigh_no;i++) energy_vertex(kp->neigh[i]);
  for(i=0;i<km->neigh_no;i++) energy_vertex(km->neigh[i]);
  for(i=0;i<it->neigh_no;i++) energy_vertex(it->neigh[i]);
  delta_energy+=k->xk* k->energy;
  delta_energy+=kp->xk* kp->energy;
  delta_energy+=km->xk* km->energy;
  delta_energy+=it->xk* it->energy;
//  for(i=0;i<k->neigh_no;i++) delta_energy+=k->neigh[i]->xk*k->neigh[i]->energy;
//  for(i=0;i<kp->neigh_no;i++) delta_energy+=kp->neigh[i]->xk*kp->neigh[i]->energy;
//  for(i=0;i<km->neigh_no;i++) delta_energy+=km->neigh[i]->xk*km->neigh[i]->energy;
//  for(i=0;i<it->neigh_no;i++) delta_energy+=it->neigh[i]->xk*it->neigh[i]->energy;
  delta_energy-=oldenergy;
 // fprintf(stderr,"I WAS HERE! Got energy!\n");
/* MONTE CARLO */
    if(delta_energy>=0){
#ifdef TS_DOUBLE_DOUBLE
        if(exp(-delta_energy)< drand48() )
#endif
#ifdef TS_DOUBLE_FLOAT
        if(expf(-delta_energy)< (ts_float)drand48())
#endif
#ifdef TS_DOUBLE_LONGDOUBLE
        if(expl(-delta_energy)< (ts_ldouble)drand48())
#endif
        {
            //not accepted, reverting changes
       //     fprintf(stderr,"Failed to move, due to MC\n");
//            ts_flip_bond(km,kp,it,k, bond);
            ts_flip_bond(kp,km,k,it, bond);
/*
fprintf(stderr,"*** Naslov k=%d\n",k);
fprintf(stderr,"*** Naslov it=%d\n",it);
fprintf(stderr,"*** Naslov km=%d\n",km);
fprintf(stderr,"*** Naslov kp=%d\n",kp);
for(i=0;i<k->neigh_no;i++)
    fprintf(stderr,"k sosed=%d\n",k->neigh[i]);
for(i=0;i<it->neigh_no;i++)
    fprintf(stderr,"it sosed=%d\n",it->neigh[i]);
for(i=0;i<km->neigh_no;i++)
    fprintf(stderr,"km sosed=%d\n",km->neigh[i]);
for(i=0;i<kp->neigh_no;i++)
    fprintf(stderr,"kp sosed=%d\n",kp->neigh[i]);
*/
        //    fprintf(stderr,"Reverted condition!\n");
            return TS_FAIL;
        }
    }
        //    fprintf(stderr,"Success\n");
/* IF BONDFLIP ACCEPTED, THEN RETURN SUCCESS! */
    return TS_SUCCESS;
    pthread_exit(0); /* exit */
}
ts_bool ts_flip_bond(ts_vertex *k,ts_vertex *it,ts_vertex *km, ts_vertex *kp,
ts_bond *bond){
    ts_triangle *lm=NULL,*lp=NULL, *lp1=NULL, *lm2=NULL;
    ts_uint i,j, lmidx, lpidx;
if(k==NULL || it==NULL || km==NULL || kp==NULL){
    fatal("ts_flip_bond: You called me with invalid pointers to vertices",999);
}
// 1. step. We find lm and lp from k->tristar !
    for(i=0;i<it->tristar_no;i++){
        for(j=0;j<k->tristar_no;j++){
            if((it->tristar[i] == k->tristar[j])){ //ce gre za skupen trikotnik
                if((it->tristar[i]->vertex[0] == km || it->tristar[i]->vertex[1]
== km || it->tristar[i]->vertex[2]== km )){
                lm=it->tristar[i];
         //       lmidx=i;
                }
                else
                {
                lp=it->tristar[i];
         //       lpidx=i;
                }
            }
        }
    }
if(lm==NULL || lp==NULL) fatal("ts_flip_bond: Cannot find triangles lm and lp!",999);
//we look for important triangles lp1 and lm2.
 for(i=0;i<k->tristar_no;i++){
        for(j=0;j<kp->tristar_no;j++){
                if((k->tristar[i] == kp->tristar[j]) && k->tristar[i]!=lp){ //ce gre za skupen trikotnik
                    lp1=k->tristar[i];
            }
        }
}
 for(i=0;i<it->tristar_no;i++){
        for(j=0;j<km->tristar_no;j++){
            if((it->tristar[i] == km->tristar[j]) && it->tristar[i]!=lm){ //ce gre za skupen trikotnik
                    lm2=it->tristar[i];
            }
        }
    }
/*
// DEBUG TESTING!
fprintf(stderr,"*** Naslov k=%d\n",k);
fprintf(stderr,"*** Naslov it=%d\n",it);
fprintf(stderr,"*** Naslov km=%d\n",km);
fprintf(stderr,"*** Naslov kp=%d\n",kp);
for(i=0;i<k->neigh_no;i++)
    fprintf(stderr,"k sosed=%d\n",k->neigh[i]);
for(i=0;i<it->neigh_no;i++)
    fprintf(stderr,"it sosed=%d\n",it->neigh[i]);
// END DEBUG TESTING!
*/
if(lm2==NULL || lp1==NULL) fatal("ts_flip_bond: Cannot find triangles lm2 and lp1!",999);
//fprintf(stderr,"1. step: lm, lm2, lp1 and lp found!\n");
/*
//DEBUG TESTING
fprintf(stderr,"--- Naslov lm=%d",lm);
fprintf(stderr,"   vtxs(%d, %d, %d)\n",lm->vertex[0],lm->vertex[1], lm->vertex[2]);
fprintf(stderr,"--- Naslov lp=%d",lp);
fprintf(stderr,"   vtxs(%d, %d, %d)\n",lp->vertex[0],lp->vertex[1], lp->vertex[2]);
fprintf(stderr,"--- Naslov lm2=%d",lm2);
fprintf(stderr,"   vtxs(%d, %d, %d)\n",lm2->vertex[0],lm2->vertex[1], lm2->vertex[2]);
fprintf(stderr,"--- Naslov lp1=%d",lp1);
fprintf(stderr,"   vtxs(%d, %d, %d)\n",lp1->vertex[0],lp1->vertex[1], lp1->vertex[2]);
for(i=0;i<lm->neigh_no;i++)
    fprintf(stderr,"lm sosed=%d\n",lm->neigh[i]);
for(i=0;i<lp->neigh_no;i++)
    fprintf(stderr,"lp sosed=%d\n",lp->neigh[i]);
// END DEBUG TESTING
*/
/*
// DEBUG TESTING!
for(i=0;i<3;i++){
    if(lp1->neigh[i]==lp) fprintf(stderr,"Nasel sem par lp1->lp\n");
    if(lp->neigh[i]==lp1) fprintf(stderr,"Nasel sem par lp->lp1\n");
    if(lm2->neigh[i]==lm) fprintf(stderr,"Nasel sem par lm2->lm\n");
    if(lm->neigh[i]==lm2) fprintf(stderr,"Nasel sem par lm->lm2\n");
}
// END DEBUG TESTING!
*/
// 2. step. We change the triangle vertices... (actual bond flip)
    for(i=0;i<3;i++) if(lm->vertex[i]== it) lm->vertex[i]= kp;
    for(i=0;i<3;i++) if(lp->vertex[i]== k) lp->vertex[i]= km;
//fprintf(stderr,"2. step: actual bondflip made\n");
// 2a. step. If any changes in triangle calculations must be done, do it here!
//   * normals are recalculated here
    triangle_normal_vector(lp);
    triangle_normal_vector(lm);
// 3. step. Correct neighbours in vertex_list
            vertex_remove_neighbour(k,it);
            vertex_remove_neighbour(it,k);
            //Tukaj pa nastopi tezava... Kam dodati soseda?
            vertex_insert_neighbour(km,kp,k);
            vertex_insert_neighbour(kp,km,it);
//            vertex_add_neighbour(km,kp); //pazi na vrstni red.
//            vertex_add_neighbour(kp,km);
//fprintf(stderr,"3. step: vertex neighbours corrected\n");
// 3a. step. If any changes to ts_vertex, do it here!
//   bond_length calculatons not required for it is done in energy.c
// 4. step. Correct bond_list (don't know why I still have it!)
            bond->vtx1=km;
            bond->vtx2=kp;
//fprintf(stderr,"4. step: bondlist corrected\n");
// 5. step. Correct neighbouring triangles
    triangle_remove_neighbour(lp,lp1);
   // fprintf(stderr,".\n");
    triangle_remove_neighbour(lp1,lp);
  //  fprintf(stderr,".\n");
    triangle_remove_neighbour(lm,lm2);
  //  fprintf(stderr,".\n");
    triangle_remove_neighbour(lm2,lm);
    triangle_add_neighbour(lm,lp1);
    triangle_add_neighbour(lp1,lm);
    triangle_add_neighbour(lp,lm2);  //Vrstni red?!
    triangle_add_neighbour(lm2,lp);
//fprintf(stderr,"5. step: triangle neigbours corrected\n");
// 6. step. Correct tristar for vertices km, kp, k and it
            vertex_add_tristar(km,lp);  // Preveri vrstni red!
            vertex_add_tristar(kp,lm);
            vertex_remove_tristar(it,lm);
            vertex_remove_tristar(k,lp);
//fprintf(stderr,"6. step: tristar corrected\n");
/*
//DEBUG TESTING
fprintf(stderr,"--- Naslov lm=%d",lm);
fprintf(stderr,"   vtxs(%d, %d, %d)\n",lm->vertex[0],lm->vertex[1], lm->vertex[2]);
fprintf(stderr,"--- Naslov lp=%d",lp);
fprintf(stderr,"   vtxs(%d, %d, %d)\n",lp->vertex[0],lp->vertex[1], lp->vertex[2]);
fprintf(stderr,"--- Naslov lm2=%d",lm2);
fprintf(stderr,"   vtxs(%d, %d, %d)\n",lm2->vertex[0],lm2->vertex[1], lm2->vertex[2]);
fprintf(stderr,"--- Naslov lp1=%d",lp1);
fprintf(stderr,"   vtxs(%d, %d, %d)\n",lp1->vertex[0],lp1->vertex[1], lp1->vertex[2]);
for(i=0;i<lm->neigh_no;i++)
    fprintf(stderr,"lm sosed=%d\n",lm->neigh[i]);
for(i=0;i<lp->neigh_no;i++)
    fprintf(stderr,"lp sosed=%d\n",lp->neigh[i]);
// END DEBUG TESTING
*/
  energy_vertex(k);
  energy_vertex(kp);
  energy_vertex(km);
  energy_vertex(it);
// END modifications to data structure!
    return TS_SUCCESS;
}