static real calc_dist(FILE *log,rvec x[])
{
- static bool bFirst=TRUE;
- static bool bDist;
+ static gmx_bool bFirst=TRUE;
+ static gmx_bool bDist;
static int i1,i2;
char *buf;
rvec dx;
void do_coupling(FILE *log,const output_env_t oenv,int nfile,
const t_filenm fnm[], t_coupl_rec *tcr,real t,
int step,real ener[], t_forcerec *fr,t_inputrec *ir,
- bool bMaster, t_mdatoms *md,t_idef *idef,real mu_aver,int nmols,
+ gmx_bool bMaster, t_mdatoms *md,t_idef *idef,real mu_aver,int nmols,
t_commrec *cr,matrix box,tensor virial,
tensor pres,rvec mu_tot,
- rvec x[],rvec f[],bool bDoIt)
+ rvec x[],rvec f[],gmx_bool bDoIt)
{
#define enm2Debye 48.0321
#define d2e(x) (x)/enm2Debye
#define enm2kjmol(x) (x)*0.0143952 /* = 2.0*4.0*M_PI*EPSILON0 */
static real *f6,*f12,*fa,*fb,*fc,*fq;
- static bool bFirst = TRUE;
+ static gmx_bool bFirst = TRUE;
int i,j,ati,atj,atnr2,type,ftype;
real deviation[eoObsNR],prdev[eoObsNR],epot0,dist,rmsf;
real ff6,ff12,ffa,ffb,ffc,ffq,factor,dt,mu_ind;
real Epol,Eintern,Virial,muabs,xiH=-1,xiS=-1,xi6,xi12;
rvec fmol[2];
- bool bTest,bPrint;
+ gmx_bool bTest,bPrint;
t_coupl_LJ *tclj;
t_coupl_BU *tcbu;
t_coupl_Q *tcq;