From bcf4557ddd61890f130247430267feac5b05c5b7 Mon Sep 17 00:00:00 2001 From: mihaf <miha.fosnaric@gmail.com> Date: Fri, 21 Mar 2014 09:39:35 +0000 Subject: [PATCH] Filament inside the vesicle added and debugged. Testing time... --- src/bondflip.c | 91 +++++++++++++++++++++++++++++++++++++++++++-- 1 files changed, 86 insertions(+), 5 deletions(-) diff --git a/src/bondflip.c b/src/bondflip.c index 4935901..23afbc9 100644 --- a/src/bondflip.c +++ b/src/bondflip.c @@ -11,6 +11,7 @@ #include "bondflip.h" //#include "io.h" #include<stdio.h> +#include<string.h> 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: @@ -113,7 +114,48 @@ } if(lm2==NULL || lp1==NULL) fatal("ts_flip_bond: Cannot find triangles lm2 and lp1!",999); + + +/* backup old structure */ +/* need to backup: + * vertices k, kp, km, it + * triangles lm, lp, lm2, lp1 + * bond + */ +ts_vertex *bck_vtx[4]; +ts_triangle *bck_tria[4]; +ts_bond *bck_bond; +ts_vertex *orig_vtx[]={k,it,kp,km}; +ts_triangle *orig_tria[]={lm,lp,lm2,lp1}; + +//fprintf(stderr,"Backuping!!!\n"); + bck_bond=(ts_bond *)malloc(sizeof(ts_bond)); +for(i=0;i<4;i++){ +/* fprintf(stderr,"vtx neigh[%d]=",i); + for(j=0;j<orig_vtx[i]->neigh_no;j++) fprintf(stderr," %d", orig_vtx[i]->neigh[j]->idx); + fprintf(stderr,"\n"); +*/ + bck_vtx[i]=(ts_vertex *)malloc(sizeof(ts_vertex)); + bck_tria[i]=(ts_triangle *)malloc(sizeof(ts_triangle)); + memcpy((void *)bck_vtx[i],(void *)orig_vtx[i],sizeof(ts_vertex)); + memcpy((void *)bck_tria[i],(void *)orig_tria[i],sizeof(ts_triangle)); + /* level 2 pointers */ + + bck_vtx[i]->neigh=(ts_vertex **)malloc(orig_vtx[i]->neigh_no*sizeof(ts_vertex *)); + bck_vtx[i]->tristar=(ts_triangle **)malloc(orig_vtx[i]->tristar_no*sizeof(ts_triangle *)); + bck_vtx[i]->bond=(ts_bond **)malloc(orig_vtx[i]->bond_no*sizeof(ts_bond *)); + bck_tria[i]->neigh=(ts_triangle **)malloc(orig_tria[i]->neigh_no*sizeof(ts_triangle *)); + + memcpy((void *)bck_vtx[i]->neigh,(void *)orig_vtx[i]->neigh,orig_vtx[i]->neigh_no*sizeof(ts_vertex *)); + memcpy((void *)bck_vtx[i]->tristar,(void *)orig_vtx[i]->tristar,orig_vtx[i]->tristar_no*sizeof(ts_triangle *)); + memcpy((void *)bck_vtx[i]->bond,(void *)orig_vtx[i]->bond,orig_vtx[i]->bond_no*sizeof(ts_bond *)); + memcpy((void *)bck_tria[i]->neigh,(void *)orig_tria[i]->neigh,orig_tria[i]->neigh_no*sizeof(ts_triangle *)); +} + memcpy(bck_bond,bond,sizeof(ts_bond)); +//fprintf(stderr,"Backup complete!!!\n"); +/* end backup vertex */ + /* Save old energy */ oldenergy=0; oldenergy+=k->xk* k->energy; @@ -155,15 +197,54 @@ #endif { //not accepted, reverting changes -// fprintf(stderr,"Failed to move, due to MC\n"); + //restore all backups +// fprintf(stderr,"Restoring!!!\n"); - ts_flip_bond(kp,km,k,it, bond, lm,lp,lm2,lp1); -// fprintf(stderr,"%e, %e, %e\n", lp->xnorm, lp->ynorm, lp->znorm); - return TS_FAIL; + for(i=0;i<4;i++){ +// fprintf(stderr,"Restoring vtx neigh[%d] with neighbours %d\n",i, orig_vtx[i]->neigh_no ); + free(orig_vtx[i]->neigh); + free(orig_vtx[i]->tristar); + free(orig_vtx[i]->bond); + free(orig_tria[i]->neigh); + memcpy((void *)orig_vtx[i],(void *)bck_vtx[i],sizeof(ts_vertex)); + memcpy((void *)orig_tria[i],(void *)bck_tria[i],sizeof(ts_triangle)); +// fprintf(stderr,"Restored vtx neigh[%d] with neighbours %d\n",i, orig_vtx[i]->neigh_no ); + /* level 2 pointers are redirected*/ + } + memcpy(bond,bck_bond,sizeof(ts_bond)); + + for(i=0;i<4;i++){ + free(bck_vtx[i]); + free(bck_tria[i]); +/* fprintf(stderr,"Restoring vtx neigh[%d] with neighbours %d =",i, orig_vtx[i]->neigh_no ); + for(j=0;j<orig_vtx[i]->neigh_no;j++) fprintf(stderr," %d", orig_vtx[i]->neigh[j]->idx); + fprintf(stderr,"\n"); */ + } + + free(bck_bond); +// fprintf(stderr,"Restoration complete!!!\n"); + + return TS_FAIL; } } /* IF BONDFLIP ACCEPTED, THEN RETURN SUCCESS! */ -// fprintf(stderr,"SUCCESS!!!\n"); + // fprintf(stderr,"SUCCESS!!!\n"); + + // delete all backups + for(i=0;i<4;i++){ + free(bck_vtx[i]->neigh); + free(bck_vtx[i]->bond); + free(bck_vtx[i]->tristar); + free(bck_vtx[i]); + free(bck_tria[i]->neigh); + free(bck_tria[i]); +/* fprintf(stderr,"Afret backup deletion vtx neigh[%d]=",i); + for(j=0;j<orig_vtx[i]->neigh_no;j++) fprintf(stderr," %d", orig_vtx[i]->neigh[j]->idx); + fprintf(stderr,"\n"); +*/ + } + free(bck_bond); + return TS_SUCCESS; } -- Gitblit v1.9.3