/* The permission is granted to use the software as is and redistribute it in its original and complete form. If you find this program useful and publish results obtained by it, please cite the program as: Michael Whitbeck, Desert Research Institute, 1991, "REACT - Program to solve kinetic equations for chemical systems". Version 1.00, this code is available from the authors or from Dr. Whitbeck. */ #include "rxn.h" #define EXTRACT /* extract, format and print selected data */ extern int inlist(); extern void setfiles(); extern char *strtok(); #define LNS 64 int pr_line(n,lst) int n, *lst; { int num,i; num = fread(Y,sizeof(double),NS+1,Ywrite); if (num > 0) { printf("%15.4e ",Y[0]); /* time */ for (i = 1; i<=n; i++)printf("%15.4e ",Y[lst[i]]); } printf("\n"); return num; } void pr_header(n,spc) int n; char *spc[]; { int i,j; register char **cpp; printf(" time"); for (cpp= &spc[1];cpp <= &spc[n]; cpp++) printf("%15s", *cpp); printf("\n"); } main(argc,argv) int argc; char **argv; { int i, num, lnct, l[20], k; char line[4000], *name[20]; register char **cpp; char *word; char *tokens=" $ ,+;:(){}[]"; setfiles(argv[1]); if ((Swrite = fopen(Species,"r"))==NULL) { printf("ERROR ON OPEN\n"); exit (0); } fscanf(Swrite,"%d%d\n", &NR,&NS); fgets(line,3999,Swrite); fclose(Swrite); line[(k=strlen(line))-1] = '\0'; SPECIES = (char *) malloc(k+1); strcpy(SPECIES,line); #ifndef EXTRACT printf("%d reacions involving %d species\n%s\n",NR,NS,SPECIES); #endif Y = (double *)malloc((NS+1)*sizeof(double)); if ((params = fopen(select,"r"))==NULL) { printf("ERROR ON OPEN\n"); exit (0); } altlist = (char *)malloc(strlen(SPECIES)+1); do { fgets(line,3999,Swrite); line[strlen(line)-1] = '\0'; if ((k = strlen(line)) < 1) break; if ((Ywrite = fopen(results,"r"))==NULL) { printf("ERROR ON OPEN\n"); exit (0); } word = strtok(line,tokens); k = 1; while(word) { i= inlist(SPECIES,word); if (i> 0) { cpp = &name[k]; *cpp = (char *)malloc(strlen(word) + 2 ); strcpy(*cpp,word); l[k++] = i; } word = strtok(NULL,tokens); } k--; lnct = 0; do { #ifndef EXTRACT if (lnct == 0) pr_header(k,name); #endif num = pr_line(k,l); lnct = (lnct > LNS ? 0: lnct+1); }while (num > 0); fclose(Ywrite); while(k>0) { cpp = &name[k]; free(*cpp); k--;} line[0] = '\0'; } while (1); free(altlist); }