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#include <stdio.h>
#include <stdlib.h>
#include <string.h>
#include <unistd.h>
#include "abevo.h"
#include "smalloc.h"
int main ()
{
printf ("Checking if processor is available...\n");
char* path;
char* pathExecpdb2gmx;
char* pathExeceditconf;
char* pathExecgenbox;
char* pathExecgrompp;
char* pathExecmdrun;
int ret;
char *Param_pdb2gmx[] = { "pdb2gmx", "-f", "cpeptide.pdb", "-o", "cpeptide.gro", "-p", "cpeptide.top",(char *)0 };
char *Param_editconf[] = { "editconf", "-f", "cpeptide.gro", "-o", "cpeptide.gro", "-d", "0.5",(char *)0 };
char *Param_genbox[] = { "genbox", "-cp", "cpeptide.gro", "-cs", "-o", "cpeptide_b4em.gro", "-p", "cpeptide.top",(char *)0 };
char *Param_grompp[] = { "grompp", "-f", "em.mdp", "-c", "cpeptide.gro", "-p", "cpeptide.top", "-o", "cpeptide_b4em.tpr", (char *)0 }; //cpeptide_b4em.gro
char *Param_mdrun[] = { "mdrun", "-nice", "4", "-s", "cpeptide_em", "-o", "cpeptide_em", "-c", "cpeptide_b4pr","-v", (char *)0 };
//leParametro("parameters.txt");
//CRIA AS VARIÁVEIS
snew(path,60);
snew(pathExecpdb2gmx,100);
snew(pathExeceditconf,100);
snew(pathExecgenbox,100);
snew(pathExecgrompp,100);
snew(pathExecmdrun,100);
path = "/home/faccioli/Projects/AbevoGROMACS_TESTE/";//retornaParametro("pathExec");
int processos;
int child = 0;
processos = 0;
while (processos <= 5) //COLOCAR A QTDE DE PROCESSOS QUE DEVEM SER EXECUTADOS
{
if (processos == 0)
{
//pdb2gmx
child = fork();//cria novo processo
if (child == 0)
{
strcat(pathExecpdb2gmx,path);
strcat(pathExecpdb2gmx,"pdb2gmx");
ret = execv (pathExecpdb2gmx, Param_pdb2gmx);
} else
{
wait(child);
processos++;
}
}
if (processos == 1)
{
//editconf
child = fork();
if (child == 0)
{
strcat(pathExeceditconf,path);
strcat(pathExeceditconf,"editconf");
ret = execv (pathExeceditconf, Param_editconf);
}else
{
wait(child);
processos++;
}
}
if (processos == 2)
{
//genbox
child = fork();
if (child == 0)
{
strcat(pathExecgenbox,path);
strcat(pathExecgenbox,"genbox");
ret = execv (pathExecgenbox, Param_genbox);
}else
{
wait(child);
processos++;
}
}
if (processos == 3)
{
//grompp
child = fork();
if (child == 0)
{
strcat(pathExecgrompp,path);
strcat(pathExecgrompp,"grompp");
ret = execv (pathExecgrompp, Param_grompp);
}else
{
wait(child);
processos++;
}
}
if (processos == 4)
{
//mdrun
child = fork();
if (child == 0)
{
printf ("COMECANDO O mdrun \n");
strcat(pathExecmdrun,path);
strcat(pathExecmdrun,"mdrun");
ret = execv (pathExecmdrun, Param_mdrun);
}else
{
wait(child);
processos++;
}
}
}
//FIM
printf ("Fim da execucao !!! \n");
return 0;
}
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