ICODE-ADC/lammps
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apply utils::logical() in more places

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This commit is contained in:
Axel Kohlmeyer
2021-09-21 14:15:02 -04:00
parent 41a3eccd1c
commit 1ba77e1629
30 changed files with 172 additions and 376 deletions
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14
src/FEP/compute_fep.cpp
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@ -124,18 +124,12 @@ ComputeFEP::ComputeFEP(LAMMPS *lmp, int narg, char **arg) :
while (iarg < narg) {
if (strcmp(arg[iarg],"tail") == 0) {
if (iarg+2 > narg) error->all(FLERR,"Illegal optional keyword "
"in compute fep");
if (strcmp(arg[iarg+1],"no") == 0) tailflag = 0;
else if (strcmp(arg[iarg+1],"yes") == 0) tailflag = 1;
else error->all(FLERR,"Illegal optional keyword in compute fep");
if (iarg+2 > narg) error->all(FLERR,"Illegal optional keyword in compute fep");
tailflag = utils::logical(FLERR,arg[iarg+1],false,lmp);
iarg += 2;
} else if (strcmp(arg[iarg],"volume") == 0) {
if (iarg+2 > narg) error->all(FLERR,"Illegal optional keyword "
"in compute fep");
if (strcmp(arg[iarg+1],"no") == 0) volumeflag = 0;
else if (strcmp(arg[iarg+1],"yes") == 0) volumeflag = 1;
else error->all(FLERR,"Illegal optional keyword in compute fep");
if (iarg+2 > narg) error->all(FLERR,"Illegal optional keyword in compute fep");
volumeflag = utils::logical(FLERR,arg[iarg+1],false,lmp);
iarg += 2;
} else
error->all(FLERR,"Illegal optional keyword in compute fep");