fprintf(stderr,"box_margin = %g\n",box_margin);
}
-static bool outside_box_minus_margin2(rvec x,matrix box)
+static gmx_bool outside_box_minus_margin2(rvec x,matrix box)
{
return ( (x[XX]<2*box_margin) || (x[XX]>box[XX][XX]-2*box_margin) ||
(x[YY]<2*box_margin) || (x[YY]>box[YY][YY]-2*box_margin) ||
(x[ZZ]<2*box_margin) || (x[ZZ]>box[ZZ][ZZ]-2*box_margin) );
}
-static bool outside_box_plus_margin(rvec x,matrix box)
+static gmx_bool outside_box_plus_margin(rvec x,matrix box)
{
return ( (x[XX]<-box_margin) || (x[XX]>box[XX][XX]+box_margin) ||
(x[YY]<-box_margin) || (x[YY]>box[YY][YY]+box_margin) ||
(x[ZZ]<-box_margin) || (x[ZZ]>box[ZZ][ZZ]+box_margin) );
}
-static int mark_res(int at, bool *mark, int natoms, t_atom *atom,int *nmark)
+static int mark_res(int at, gmx_bool *mark, int natoms, t_atom *atom,int *nmark)
{
int resind;
static t_forcerec *fr=NULL;
-void do_nsgrid(FILE *fp,bool bVerbose,
+void do_nsgrid(FILE *fp,gmx_bool bVerbose,
matrix box,rvec x[],t_atoms *atoms,real rlong,
const output_env_t oenv)
{
fprintf(stderr,"Successfully made neighbourlist\n");
}
-bool bXor(bool b1,bool b2)
+gmx_bool bXor(gmx_bool b1,gmx_bool b2)
{
return (b1 && !b2) || (b2 && !b1);
}
-void add_conf(t_atoms *atoms, rvec **x, rvec **v, real **r, bool bSrenew,
- int ePBC, matrix box, bool bInsert,
+void add_conf(t_atoms *atoms, rvec **x, rvec **v, real **r, gmx_bool bSrenew,
+ int ePBC, matrix box, gmx_bool bInsert,
t_atoms *atoms_solvt,rvec *x_solvt,rvec *v_solvt,real *r_solvt,
- bool bVerbose,real rshell,int max_sol, const output_env_t oenv)
+ gmx_bool bVerbose,real rshell,int max_sol, const output_env_t oenv)
{
t_nblist *nlist;
t_atoms *atoms_all;
int dx0,dx1,dy0,dy1,dz0,dz1;
int ntest,nremove,nkeep;
rvec dx,xi,xj,xpp,*x_all,*v_all;
- bool *remove,*keep;
+ gmx_bool *remove,*keep;
int bSolSol;
natoms_prot = atoms->nr;