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add url to angle_coeff messages

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This commit is contained in:
megmcca
2025-02-10 09:48:08 -07:00
parent 0a4eea6aa0
commit 8025a494d9
23 changed files with 56 additions and 56 deletions
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10
src/AMOEBA/angle_amoeba.cpp
View File

@ -623,7 +623,7 @@ void AngleAmoeba::allocate()
void AngleAmoeba::coeff(int narg, char **arg)
{
if (narg < 2) error->all(FLERR,"Incorrect args for angle coefficients");
if (narg < 2) error->all(FLERR,"Incorrect args for angle coefficients" + utils::errorurl(21));
if (!allocated) allocate();
int ilo,ihi;
@ -632,7 +632,7 @@ void AngleAmoeba::coeff(int narg, char **arg)
int count = 0;
if (strcmp(arg[1],"ba") == 0) {
if (narg != 6) error->all(FLERR,"Incorrect args for angle coefficients");
if (narg != 6) error->all(FLERR,"Incorrect args for angle coefficients" + utils::errorurl(21));
double ba_k1_one = utils::numeric(FLERR,arg[2],false,lmp);
double ba_k2_one = utils::numeric(FLERR,arg[3],false,lmp);
@ -649,7 +649,7 @@ void AngleAmoeba::coeff(int narg, char **arg)
}
} else if (strcmp(arg[1],"ub") == 0) {
if (narg != 4) error->all(FLERR,"Incorrect args for angle coefficients");
if (narg != 4) error->all(FLERR,"Incorrect args for angle coefficients" + utils::errorurl(21));
double ub_k_one = utils::numeric(FLERR,arg[2],false,lmp);
double ub_r0_one = utils::numeric(FLERR,arg[3],false,lmp);
@ -662,7 +662,7 @@ void AngleAmoeba::coeff(int narg, char **arg)
}
} else {
if (narg != 9) error->all(FLERR,"Incorrect args for angle coefficients");
if (narg != 9) error->all(FLERR,"Incorrect args for angle coefficients" + utils::errorurl(21));
int pflag_one = utils::inumeric(FLERR,arg[1],false,lmp);
int ubflag_one = utils::inumeric(FLERR,arg[2],false,lmp);
@ -689,7 +689,7 @@ void AngleAmoeba::coeff(int narg, char **arg)
}
}
if (count == 0) error->all(FLERR,"Incorrect args for angle coefficients");
if (count == 0) error->all(FLERR,"Incorrect args for angle coefficients" + utils::errorurl(21));
for (int i = ilo; i <= ihi; i++)
if (setflag_a[i] == 1 && setflag_ba[i] == 1 && setflag_ub[i])

6
src/CG-SPICA/angle_spica.cpp
View File

@ -249,7 +249,7 @@ void AngleSPICA::allocate()
void AngleSPICA::coeff(int narg, char **arg)
{
if ((narg < 3) || (narg > 6))
error->all(FLERR,"Incorrect args for angle coefficients");
error->all(FLERR,"Incorrect args for angle coefficients" + utils::errorurl(21));
if (!allocated) allocate();
@ -270,7 +270,7 @@ void AngleSPICA::coeff(int narg, char **arg)
if (repscale_one > 0.0) repscale_one = 1.0;
} else if (narg == 4) repscale_one = utils::numeric(FLERR,arg[3],false,lmp);
else if (narg == 3) repscale_one = 1.0;
else error->all(FLERR,"Incorrect args for angle coefficients");
else error->all(FLERR,"Incorrect args for angle coefficients" + utils::errorurl(21));
// convert theta0 from degrees to radians and store coefficients
@ -283,7 +283,7 @@ void AngleSPICA::coeff(int narg, char **arg)
count++;
}
if (count == 0) error->all(FLERR,"Incorrect args for angle coefficients");
if (count == 0) error->all(FLERR,"Incorrect args for angle coefficients" + utils::errorurl(21));
}
/* ----------------------------------------------------------------------

10
src/CLASS2/angle_class2.cpp
View File

@ -272,7 +272,7 @@ void AngleClass2::allocate()
void AngleClass2::coeff(int narg, char **arg)
{
if (narg < 2) error->all(FLERR,"Incorrect args for angle coefficients");
if (narg < 2) error->all(FLERR,"Incorrect args for angle coefficients" + utils::errorurl(21));
if (!allocated) allocate();
int ilo,ihi;
@ -281,7 +281,7 @@ void AngleClass2::coeff(int narg, char **arg)
int count = 0;
if (strcmp(arg[1],"bb") == 0) {
if (narg != 5) error->all(FLERR,"Incorrect args for angle coefficients");
if (narg != 5) error->all(FLERR,"Incorrect args for angle coefficients" + utils::errorurl(21));
double bb_k_one = utils::numeric(FLERR,arg[2],false,lmp);
double bb_r1_one = utils::numeric(FLERR,arg[3],false,lmp);
@ -296,7 +296,7 @@ void AngleClass2::coeff(int narg, char **arg)
}
} else if (strcmp(arg[1],"ba") == 0) {
if (narg != 6) error->all(FLERR,"Incorrect args for angle coefficients");
if (narg != 6) error->all(FLERR,"Incorrect args for angle coefficients" + utils::errorurl(21));
double ba_k1_one = utils::numeric(FLERR,arg[2],false,lmp);
double ba_k2_one = utils::numeric(FLERR,arg[3],false,lmp);
@ -313,7 +313,7 @@ void AngleClass2::coeff(int narg, char **arg)
}
} else {
if (narg != 5) error->all(FLERR,"Incorrect args for angle coefficients");
if (narg != 5) error->all(FLERR,"Incorrect args for angle coefficients" + utils::errorurl(21));
double theta0_one = utils::numeric(FLERR,arg[1],false,lmp);
double k2_one = utils::numeric(FLERR,arg[2],false,lmp);
@ -332,7 +332,7 @@ void AngleClass2::coeff(int narg, char **arg)
}
}
if (count == 0) error->all(FLERR,"Incorrect args for angle coefficients");
if (count == 0) error->all(FLERR,"Incorrect args for angle coefficients" + utils::errorurl(21));
for (int i = ilo; i <= ihi; i++)
if (setflag_a[i] == 1 && setflag_bb[i] == 1 && setflag_ba[i] == 1)

4
src/DIPOLE/angle_dipole.cpp
View File

@ -160,7 +160,7 @@ void AngleDipole::allocate()
void AngleDipole::coeff(int narg, char **arg)
{
if (narg != 3) error->all(FLERR, "Incorrect args for angle coefficients");
if (narg != 3) error->all(FLERR, "Incorrect args for angle coefficients" + utils::errorurl(21));
if (!allocated) allocate();
int ilo, ihi;
@ -179,7 +179,7 @@ void AngleDipole::coeff(int narg, char **arg)
count++;
}
if (count == 0) error->all(FLERR, "Incorrect args for angle coefficients");
if (count == 0) error->all(FLERR, "Incorrect args for angle coefficients" + utils::errorurl(21));
}
/* ----------------------------------------------------------------------

6
src/EXTRA-MOLECULE/angle_cosine_periodic.cpp
View File

@ -201,7 +201,7 @@ void AngleCosinePeriodic::allocate()
void AngleCosinePeriodic::coeff(int narg, char **arg)
{
if (narg != 4) error->all(FLERR,"Incorrect args for angle coefficients");
if (narg != 4) error->all(FLERR,"Incorrect args for angle coefficients" + utils::errorurl(21));
if (!allocated) allocate();
int ilo,ihi;
@ -210,7 +210,7 @@ void AngleCosinePeriodic::coeff(int narg, char **arg)
double c_one = utils::numeric(FLERR,arg[1],false,lmp);
int b_one = utils::inumeric(FLERR,arg[2],false,lmp);
int n_one = utils::inumeric(FLERR,arg[3],false,lmp);
if (n_one <= 0) error->all(FLERR,"Incorrect args for angle coefficients");
if (n_one <= 0) error->all(FLERR,"Incorrect args for angle coefficients" + utils::errorurl(21));
int count = 0;
for (int i = ilo; i <= ihi; i++) {
@ -221,7 +221,7 @@ void AngleCosinePeriodic::coeff(int narg, char **arg)
count++;
}
if (count == 0) error->all(FLERR,"Incorrect args for angle coefficients");
if (count == 0) error->all(FLERR,"Incorrect args for angle coefficients" + utils::errorurl(21));
}
/* ---------------------------------------------------------------------- */

4
src/EXTRA-MOLECULE/angle_cosine_shift.cpp
View File

@ -172,7 +172,7 @@ void AngleCosineShift::allocate()
void AngleCosineShift::coeff(int narg, char **arg)
{
if (narg != 3) error->all(FLERR,"Incorrect args for angle coefficients");
if (narg != 3) error->all(FLERR,"Incorrect args for angle coefficients" + utils::errorurl(21));
if (!allocated) allocate();
int ilo,ihi;
@ -194,7 +194,7 @@ void AngleCosineShift::coeff(int narg, char **arg)
count++;
}
if (count == 0) error->all(FLERR,"Incorrect args for angle coefficients");
if (count == 0) error->all(FLERR,"Incorrect args for angle coefficients" + utils::errorurl(21));
}
/* ---------------------------------------------------------------------- */

4
src/EXTRA-MOLECULE/angle_cosine_shift_exp.cpp
View File

@ -200,7 +200,7 @@ void AngleCosineShiftExp::allocate()
void AngleCosineShiftExp::coeff(int narg, char **arg)
{
if (narg != 4) error->all(FLERR,"Incorrect args for angle coefficients");
if (narg != 4) error->all(FLERR,"Incorrect args for angle coefficients" + utils::errorurl(21));
if (!allocated) allocate();
int ilo,ihi;
@ -225,7 +225,7 @@ void AngleCosineShiftExp::coeff(int narg, char **arg)
count++;
}
if (count == 0) error->all(FLERR,"Incorrect args for angle coefficients");
if (count == 0) error->all(FLERR,"Incorrect args for angle coefficients" + utils::errorurl(21));
}
/* ---------------------------------------------------------------------- */

4
src/EXTRA-MOLECULE/angle_cosine_squared_restricted.cpp
View File

@ -166,7 +166,7 @@ void AngleCosineSquaredRestricted::allocate()
void AngleCosineSquaredRestricted::coeff(int narg, char **arg)
{
if (narg != 3) error->all(FLERR, "Incorrect args for angle coefficients");
if (narg != 3) error->all(FLERR, "Incorrect args for angle coefficients" + utils::errorurl(21));
if (!allocated) allocate();
int ilo, ihi;
@ -185,7 +185,7 @@ void AngleCosineSquaredRestricted::coeff(int narg, char **arg)
count++;
}
if (count == 0) error->all(FLERR, "Incorrect args for angle coefficients");
if (count == 0) error->all(FLERR, "Incorrect args for angle coefficients" + utils::errorurl(21));
}
/* ---------------------------------------------------------------------- */

4
src/EXTRA-MOLECULE/angle_fourier.cpp
View File

@ -174,7 +174,7 @@ void AngleFourier::allocate()
void AngleFourier::coeff(int narg, char **arg)
{
if (narg != 5) error->all(FLERR,"Incorrect args for angle coefficients");
if (narg != 5) error->all(FLERR,"Incorrect args for angle coefficients" + utils::errorurl(21));
if (!allocated) allocate();
int ilo,ihi;
@ -195,7 +195,7 @@ void AngleFourier::coeff(int narg, char **arg)
count++;
}
if (count == 0) error->all(FLERR,"Incorrect args for angle coefficients");
if (count == 0) error->all(FLERR,"Incorrect args for angle coefficients" + utils::errorurl(21));
}
/* ---------------------------------------------------------------------- */

4
src/EXTRA-MOLECULE/angle_fourier_simple.cpp
View File

@ -191,7 +191,7 @@ void AngleFourierSimple::allocate()
void AngleFourierSimple::coeff(int narg, char **arg)
{
if (narg != 4) error->all(FLERR, "Incorrect args for angle coefficients");
if (narg != 4) error->all(FLERR, "Incorrect args for angle coefficients" + utils::errorurl(21));
if (!allocated) allocate();
int ilo, ihi;
@ -210,7 +210,7 @@ void AngleFourierSimple::coeff(int narg, char **arg)
count++;
}
if (count == 0) error->all(FLERR, "Incorrect args for angle coefficients");
if (count == 0) error->all(FLERR, "Incorrect args for angle coefficients" + utils::errorurl(21));
}
/* ---------------------------------------------------------------------- */

2
src/EXTRA-MOLECULE/angle_gaussian.cpp
View File

@ -236,7 +236,7 @@ void AngleGaussian::coeff(int narg, char **arg)
count++;
}
if (count == 0) error->all(FLERR, "Incorrect args for angle coefficients");
if (count == 0) error->all(FLERR, "Incorrect args for angle coefficients" + utils::errorurl(21));
}
/* ---------------------------------------------------------------------- */

4
src/EXTRA-MOLECULE/angle_mwlc.cpp
View File

@ -174,7 +174,7 @@ void AngleMWLC::allocate()
void AngleMWLC::coeff(int narg, char **arg)
{
if (narg != 5) error->all(FLERR, "Incorrect args for angle coefficients");
if (narg != 5) error->all(FLERR, "Incorrect args for angle coefficients" + utils::errorurl(21));
if (!allocated) allocate();
int ilo, ihi;
@ -195,7 +195,7 @@ void AngleMWLC::coeff(int narg, char **arg)
count++;
}
if (count == 0) error->all(FLERR, "Incorrect args for angle coefficients");
if (count == 0) error->all(FLERR, "Incorrect args for angle coefficients" + utils::errorurl(21));
}
/* ---------------------------------------------------------------------- */

4
src/EXTRA-MOLECULE/angle_quartic.cpp
View File

@ -183,7 +183,7 @@ void AngleQuartic::allocate()
void AngleQuartic::coeff(int narg, char **arg)
{
if (narg != 5) error->all(FLERR,"Incorrect args for angle coefficients");
if (narg != 5) error->all(FLERR,"Incorrect args for angle coefficients" + utils::errorurl(21));
if (!allocated) allocate();
int ilo,ihi;
@ -206,7 +206,7 @@ void AngleQuartic::coeff(int narg, char **arg)
count++;
}
if (count == 0) error->all(FLERR,"Incorrect args for angle coefficients");
if (count == 0) error->all(FLERR,"Incorrect args for angle coefficients" + utils::errorurl(21));
}
/* ---------------------------------------------------------------------- */

2
src/LEPTON/angle_lepton.cpp
View File

@ -298,7 +298,7 @@ void AngleLepton::coeff(int narg, char **arg)
count++;
}
if (count == 0) error->all(FLERR, "Incorrect args for angle coefficients");
if (count == 0) error->all(FLERR, "Incorrect args for angle coefficients" + utils::errorurl(21));
}
/* ---------------------------------------------------------------------- */

10
src/MOFFF/angle_class2_p6.cpp
View File

@ -279,7 +279,7 @@ void AngleClass2P6::allocate()
void AngleClass2P6::coeff(int narg, char **arg)
{
if (narg < 2) error->all(FLERR,"Incorrect args for angle coefficients");
if (narg < 2) error->all(FLERR,"Incorrect args for angle coefficients" + utils::errorurl(21));
if (!allocated) allocate();
int ilo,ihi;
@ -288,7 +288,7 @@ void AngleClass2P6::coeff(int narg, char **arg)
int count = 0;
if (strcmp(arg[1],"bb") == 0) {
if (narg != 5) error->all(FLERR,"Incorrect args for angle coefficients");
if (narg != 5) error->all(FLERR,"Incorrect args for angle coefficients" + utils::errorurl(21));
double bb_k_one = utils::numeric(FLERR,arg[2],false,lmp);
double bb_r1_one = utils::numeric(FLERR,arg[3],false,lmp);
@ -303,7 +303,7 @@ void AngleClass2P6::coeff(int narg, char **arg)
}
} else if (strcmp(arg[1],"ba") == 0) {
if (narg != 6) error->all(FLERR,"Incorrect args for angle coefficients");
if (narg != 6) error->all(FLERR,"Incorrect args for angle coefficients" + utils::errorurl(21));
double ba_k1_one = utils::numeric(FLERR,arg[2],false,lmp);
double ba_k2_one = utils::numeric(FLERR,arg[3],false,lmp);
@ -320,7 +320,7 @@ void AngleClass2P6::coeff(int narg, char **arg)
}
} else {
if (narg != 7) error->all(FLERR,"Incorrect args for angle coefficients");
if (narg != 7) error->all(FLERR,"Incorrect args for angle coefficients" + utils::errorurl(21));
double theta0_one = utils::numeric(FLERR,arg[1],false,lmp);
double k2_one = utils::numeric(FLERR,arg[2],false,lmp);
@ -343,7 +343,7 @@ void AngleClass2P6::coeff(int narg, char **arg)
}
}
if (count == 0) error->all(FLERR,"Incorrect args for angle coefficients");
if (count == 0) error->all(FLERR,"Incorrect args for angle coefficients" + utils::errorurl(21));
for (int i = ilo; i <= ihi; i++)
if (setflag_a[i] == 1 && setflag_bb[i] == 1 && setflag_ba[i] == 1)

6
src/MOFFF/angle_cosine_buck6d.cpp
View File

@ -248,7 +248,7 @@ void AngleCosineBuck6d::allocate()
void AngleCosineBuck6d::coeff(int narg, char **arg)
{
if (narg != 4) error->all(FLERR,"Incorrect args for angle coefficients");
if (narg != 4) error->all(FLERR,"Incorrect args for angle coefficients" + utils::errorurl(21));
if (!allocated) allocate();
int ilo,ihi;
@ -257,7 +257,7 @@ void AngleCosineBuck6d::coeff(int narg, char **arg)
double c_one = utils::numeric(FLERR,arg[1],false,lmp);
int n_one = utils::inumeric(FLERR,arg[2],false,lmp);
int th0_one = utils::numeric(FLERR,arg[3],false,lmp);
if (n_one <= 0) error->all(FLERR,"Incorrect args for angle coefficients");
if (n_one <= 0) error->all(FLERR,"Incorrect args for angle coefficients" + utils::errorurl(21));
int count = 0;
@ -271,7 +271,7 @@ void AngleCosineBuck6d::coeff(int narg, char **arg)
count++;
}
if (count == 0) error->all(FLERR,"Incorrect args for angle coefficients");
if (count == 0) error->all(FLERR,"Incorrect args for angle coefficients" + utils::errorurl(21));
}
/* ----------------------------------------------------------------------

4
src/MOLECULE/angle_charmm.cpp
View File

@ -196,7 +196,7 @@ void AngleCharmm::allocate()
void AngleCharmm::coeff(int narg, char **arg)
{
if (narg != 5) error->all(FLERR, "Incorrect args for angle coefficients");
if (narg != 5) error->all(FLERR, "Incorrect args for angle coefficients" + utils::errorurl(21));
if (!allocated) allocate();
int ilo, ihi;
@ -219,7 +219,7 @@ void AngleCharmm::coeff(int narg, char **arg)
count++;
}
if (count == 0) error->all(FLERR, "Incorrect args for angle coefficients");
if (count == 0) error->all(FLERR, "Incorrect args for angle coefficients" + utils::errorurl(21));
}
/* ---------------------------------------------------------------------- */

4
src/MOLECULE/angle_cosine.cpp
View File

@ -155,7 +155,7 @@ void AngleCosine::allocate()
void AngleCosine::coeff(int narg, char **arg)
{
if (narg != 2) error->all(FLERR, "Incorrect args for angle coefficients");
if (narg != 2) error->all(FLERR, "Incorrect args for angle coefficients" + utils::errorurl(21));
if (!allocated) allocate();
int ilo, ihi;
@ -170,7 +170,7 @@ void AngleCosine::coeff(int narg, char **arg)
count++;
}
if (count == 0) error->all(FLERR, "Incorrect args for angle coefficients");
if (count == 0) error->all(FLERR, "Incorrect args for angle coefficients" + utils::errorurl(21));
}
/* ---------------------------------------------------------------------- */

4
src/MOLECULE/angle_cosine_squared.cpp
View File

@ -169,7 +169,7 @@ void AngleCosineSquared::allocate()
void AngleCosineSquared::coeff(int narg, char **arg)
{
if (narg != 3) error->all(FLERR, "Incorrect args for angle coefficients");
if (narg != 3) error->all(FLERR, "Incorrect args for angle coefficients" + utils::errorurl(21));
if (!allocated) allocate();
int ilo, ihi;
@ -188,7 +188,7 @@ void AngleCosineSquared::coeff(int narg, char **arg)
count++;
}
if (count == 0) error->all(FLERR, "Incorrect args for angle coefficients");
if (count == 0) error->all(FLERR, "Incorrect args for angle coefficients" + utils::errorurl(21));
}
/* ---------------------------------------------------------------------- */

4
src/MOLECULE/angle_harmonic.cpp
View File

@ -172,7 +172,7 @@ void AngleHarmonic::allocate()
void AngleHarmonic::coeff(int narg, char **arg)
{
if (narg != 3) error->all(FLERR, "Incorrect args for angle coefficients");
if (narg != 3) error->all(FLERR, "Incorrect args for angle coefficients" + utils::errorurl(21));
if (!allocated) allocate();
int ilo, ihi;
@ -191,7 +191,7 @@ void AngleHarmonic::coeff(int narg, char **arg)
count++;
}
if (count == 0) error->all(FLERR, "Incorrect args for angle coefficients");
if (count == 0) error->all(FLERR, "Incorrect args for angle coefficients" + utils::errorurl(21));
}
/* ---------------------------------------------------------------------- */

4
src/YAFF/angle_cross.cpp
View File

@ -220,7 +220,7 @@ void AngleCross::allocate()
void AngleCross::coeff(int narg, char **arg)
{
if (narg != 7) error->all(FLERR,"Incorrect args for angle coefficients");
if (narg != 7) error->all(FLERR,"Incorrect args for angle coefficients" + utils::errorurl(21));
if (!allocated) allocate();
int ilo,ihi;
@ -247,7 +247,7 @@ void AngleCross::coeff(int narg, char **arg)
count++;
}
if (count == 0) error->all(FLERR,"Incorrect args for angle coefficients");
if (count == 0) error->all(FLERR,"Incorrect args for angle coefficients" + utils::errorurl(21));
}
/* ---------------------------------------------------------------------- */

4
src/YAFF/angle_mm3.cpp
View File

@ -180,7 +180,7 @@ void AngleMM3::allocate()
void AngleMM3::coeff(int narg, char **arg)
{
if (narg != 3) error->all(FLERR,"Incorrect args for angle coefficients");
if (narg != 3) error->all(FLERR,"Incorrect args for angle coefficients" + utils::errorurl(21));
if (!allocated) allocate();
int ilo,ihi;
@ -200,7 +200,7 @@ void AngleMM3::coeff(int narg, char **arg)
count++;
}
if (count == 0) error->all(FLERR,"Incorrect args for angle coefficients");
if (count == 0) error->all(FLERR,"Incorrect args for angle coefficients" + utils::errorurl(21));
}

4
src/angle_zero.cpp
View File

@ -83,7 +83,7 @@ void AngleZero::allocate()
void AngleZero::coeff(int narg, char **arg)
{
if ((narg < 1) || (coeffflag && narg > 2))
error->all(FLERR, "Incorrect args for angle coefficients");
error->all(FLERR, "Incorrect args for angle coefficients" + utils::errorurl(21));
if (!allocated) allocate();
@ -102,7 +102,7 @@ void AngleZero::coeff(int narg, char **arg)
count++;
}
if (count == 0) error->all(FLERR, "Incorrect args for angle coefficients");
if (count == 0) error->all(FLERR, "Incorrect args for angle coefficients" + utils::errorurl(21));
}
/* ---------------------------------------------------------------------- */