#define NFILE asize(fnm)
/* Command line options ! */
- bool bCart = FALSE;
- bool bPPPME = FALSE;
- bool bPartDec = FALSE;
- bool bDDBondCheck = TRUE;
- bool bDDBondComm = TRUE;
- bool bVerbose = FALSE;
- bool bCompact = TRUE;
- bool bSepPot = FALSE;
- bool bRerunVSite = FALSE;
- bool bIonize = FALSE;
- bool bConfout = TRUE;
- bool bReproducible = FALSE;
+ gmx_bool bCart = FALSE;
+ gmx_bool bPPPME = FALSE;
+ gmx_bool bPartDec = FALSE;
+ gmx_bool bDDBondCheck = TRUE;
+ gmx_bool bDDBondComm = TRUE;
+ gmx_bool bVerbose = FALSE;
+ gmx_bool bCompact = TRUE;
+ gmx_bool bSepPot = FALSE;
+ gmx_bool bRerunVSite = FALSE;
+ gmx_bool bIonize = FALSE;
+ gmx_bool bConfout = TRUE;
+ gmx_bool bReproducible = FALSE;
int npme=-1;
int nmultisim=0;
real rdd=0.0,rconstr=0.0,dlb_scale=0.8,pforce=-1;
char *ddcsx=NULL,*ddcsy=NULL,*ddcsz=NULL;
real cpt_period=15.0,max_hours=-1;
- bool bAppendFiles=TRUE;
- bool bKeepAndNumCPT=FALSE;
- bool bResetCountersHalfWay=FALSE;
+ gmx_bool bAppendFiles=TRUE;
+ gmx_bool bKeepAndNumCPT=FALSE;
+ gmx_bool bResetCountersHalfWay=FALSE;
output_env_t oenv=NULL;
const char *deviceOptions = "";
unsigned long Flags, PCA_Flags;
ivec ddxyz;
int dd_node_order;
- bool bAddPart;
+ gmx_bool bAddPart;
FILE *fplog,*fptest;
int sim_part,sim_part_fn;
const char *part_suffix=".part";