}
#ifdef DEBUG
-static void pr_nbfp(FILE *fp,real *nbfp,bool bBHAM,int atnr)
+static void pr_nbfp(FILE *fp,real *nbfp,gmx_bool bBHAM,int atnr)
{
int i,j;
}
#endif
-static real *mk_nbfp(const gmx_ffparams_t *idef,bool bBHAM)
+static real *mk_nbfp(const gmx_ffparams_t *idef,gmx_bool bBHAM)
{
real *nbfp;
int i,j,k,atnr;
t_atom *atom;
int j,k;
int j0,j1,nj;
- bool perturbed;
- bool has_vdw[4];
- bool match;
+ gmx_bool perturbed;
+ gmx_bool has_vdw[4];
+ gmx_bool match;
real tmp_charge[4];
int tmp_vdwtype[4];
int tjA;
- bool qm;
+ gmx_bool qm;
solvent_parameters_t *solvent_parameters;
/* We use a list with parameters for each solvent type.
}
static cginfo_mb_t *init_cginfo_mb(FILE *fplog,const gmx_mtop_t *mtop,
- t_forcerec *fr,bool bNoSolvOpt,
- bool *bExcl_IntraCGAll_InterCGNone)
+ t_forcerec *fr,gmx_bool bNoSolvOpt,
+ gmx_bool *bExcl_IntraCGAll_InterCGNone)
{
const t_block *cgs;
const t_blocka *excl;
int *cginfo;
int cg_offset,a_offset,cgm,am;
int mb,m,ncg_tot,cg,a0,a1,gid,ai,j,aj,excl_nalloc;
- bool bId,*bExcl,bExclIntraAll,bExclInter;
+ gmx_bool bId,*bExcl,bExclIntraAll,bExclInter;
ncg_tot = ncg_mtop(mtop);
snew(cginfo_mb,mtop->nmolblock);
#endif
double csix,ctwelve;
int ntp,*typecount;
- bool bBHAM;
+ gmx_bool bBHAM;
real *nbfp;
ntp = fr->ntype;
return cutoff;
}
-bool can_use_allvsall(const t_inputrec *ir, const gmx_mtop_t *mtop,
- bool bPrintNote,t_commrec *cr,FILE *fp)
+gmx_bool can_use_allvsall(const t_inputrec *ir, const gmx_mtop_t *mtop,
+ gmx_bool bPrintNote,t_commrec *cr,FILE *fp)
{
- bool bAllvsAll;
+ gmx_bool bAllvsAll;
bAllvsAll =
(
const gmx_mtop_t *mtop,
const t_commrec *cr,
matrix box,
- bool bMolEpot,
+ gmx_bool bMolEpot,
const char *tabfn,
const char *tabpfn,
const char *tabbfn,
- bool bNoSolvOpt,
+ gmx_bool bNoSolvOpt,
real print_force)
{
int i,j,m,natoms,ngrp,negp_pp,negptable,egi,egj;
double dbl;
rvec box_size;
const t_block *cgs;
- bool bGenericKernelOnly;
- bool bTab,bSep14tab,bNormalnblists;
+ gmx_bool bGenericKernelOnly;
+ gmx_bool bTab,bSep14tab,bNormalnblists;
t_nblists *nbl;
int *nm_ind,egp_flags;