{
(void) pr_indent(fp,indent);
(void) fprintf(fp,"%s[%d]=%s\n",title,bShowNumbers?i:-1,
- BOOL(vec[i]));
+ EBOOL(vec[i]));
}
}
}
fprintf(fp,"rotation_group %d:\n",g);
indent += 2;
PS("type",EROTGEOM(rotg->eType));
- PS("massw",BOOL(rotg->bMassW));
+ PS("massw",EBOOL(rotg->bMassW));
pr_ivec_block(fp,indent,"atom",rotg->ind,rotg->nat,TRUE);
pr_rvecs(fp,indent,"x_ref",rotg->x_ref,rotg->nat);
pr_rvec(fp,indent,"vec",rotg->vec,DIM,TRUE);
PR("ewald-rtol",ir->ewald_rtol);
PR("ewald-geometry",ir->ewald_geometry);
PR("epsilon-surface",ir->epsilon_surface);
- PS("optimize-fft",BOOL(ir->bOptFFT));
+ PS("optimize-fft",EBOOL(ir->bOptFFT));
PS("ePBC",EPBC(ir->ePBC));
- PS("bPeriodicMols",BOOL(ir->bPeriodicMols));
- PS("bContinuation",BOOL(ir->bContinuation));
- PS("bShakeSOR",BOOL(ir->bShakeSOR));
+ PS("bPeriodicMols",EBOOL(ir->bPeriodicMols));
+ PS("bContinuation",EBOOL(ir->bContinuation));
+ PS("bShakeSOR",EBOOL(ir->bShakeSOR));
PS("etc",ETCOUPLTYPE(ir->etc));
PI("nsttcouple",ir->nsttcouple);
PS("epc",EPCOUPLTYPE(ir->epc));
if (ir->ePull != epullNO)
pr_pull(fp,indent,ir->pull);
- PS("rotation",BOOL(ir->bRot));
+ PS("rotation",EBOOL(ir->bRot));
if (ir->bRot)
pr_rot(fp,indent,ir->rot);
PS("disre",EDISRETYPE(ir->eDisre));
PS("disre-weighting",EDISREWEIGHTING(ir->eDisreWeighting));
- PS("disre-mixed",BOOL(ir->bDisreMixed));
+ PS("disre-mixed",EBOOL(ir->bDisreMixed));
PR("dr-fc",ir->dr_fc);
PR("dr-tau",ir->dr_tau);
PR("nstdisreout",ir->nstdisreout);
PR("cos-accel",ir->cos_accel);
pr_matrix(fp,indent,"deform",ir->deform,bMDPformat);
- PS("adress",BOOL(ir->bAdress));
+ PS("adress",EBOOL(ir->bAdress));
if (ir->bAdress){
PS("adress_type",EADRESSTYPE(ir->adress->type));
PR("adress_const_wf",ir->adress->const_wf);
PS("adress_interface_correction",EADRESSICTYPE(ir->adress->icor));
PS("adress_site",EADRESSSITETYPE(ir->adress->site));
PR("adress_ex_force_cap",ir->adress->ex_forcecap);
- PS("adress_do_hybridpairs", BOOL(ir->adress->do_hybridpairs));
+ PS("adress_do_hybridpairs", EBOOL(ir->adress->do_hybridpairs));
pr_rvec(fp,indent,"adress_reference_coords",ir->adress->refs,DIM,TRUE);
}
pr_cosine(fp,indent,"efield-yt",&(ir->et[YY]),bMDPformat);
pr_cosine(fp,indent,"efield-z",&(ir->ex[ZZ]),bMDPformat);
pr_cosine(fp,indent,"efield-zt",&(ir->et[ZZ]),bMDPformat);
- PS("bQMMM",BOOL(ir->bQMMM));
+ PS("bQMMM",EBOOL(ir->bQMMM));
PI("QMconstraints",ir->QMconstraints);
PI("QMMMscheme",ir->QMMMscheme);
PR("scalefactor",ir->scalefactor);