Trisurf Monte Carlo simulator
Samo Penic
2013-11-23 50f10f120936a429dc450f58a40951fa5d59458a
src/timestep.c
@@ -1,33 +1,122 @@
#include<stdlib.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_t mutex_taint, mutex_untaint;
   pthread_mutex_init(&mutex_taint,NULL);
   pthread_mutex_init(&mutex_untaint,NULL);
   for(i=0;i<vesicle->threads;i++){
      data[i].thread_no=i;
      data[i].vesicle=vesicle;
      data[i].threads=vesicle->threads;
      data[i].vtx_tainting_lock=&mutex_taint;
      data[i].vtx_untainting_lock=&mutex_untaint;
   }
    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(&mutex_taint);
   pthread_mutex_destroy(&mutex_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->vtx[i],rnvec);
   /**** THREAD IS POTENTIALLY LOCKED ******/
   pthread_mutex_lock(data->vtx_tainting_lock); //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. Level=%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 ", vesicle->vlist->vtx[i]->neigh[j]->idx);
      }
      ts_fprintf(stdout, ".\n");
   }
   pthread_mutex_lock(data->vtx_untainting_lock);
   vertex_taint(vesicle->vlist->vtx[i],2);
   pthread_mutex_unlock(data->vtx_untainting_lock);
   pthread_mutex_unlock(data->vtx_tainting_lock);
   /**** THREAD IS RELEASING MUTEX RESOURCES ******/
        single_verticle_timestep(vesicle,vesicle->vlist->vtx[i],rnvec);
   pthread_mutex_lock(data->vtx_untainting_lock);
   vertex_untaint(vesicle->vlist->vtx[i],2);
   pthread_mutex_unlock(data->vtx_untainting_lock);
//      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;
*/
    pthread_exit(0); /* exit */
}