fix whitespace

This commit is contained in:
Steve Plimpton
2025-05-15 17:04:18 -06:00
parent 06616c5ff3
commit ebfb94a717
7 changed files with 17 additions and 17 deletions

View File

@ -184,7 +184,7 @@ void PythonImpl::command(int narg, char **arg)
// one with no return value
// it also means there is no need to call Variable::pythonstyle() here
// or even define the pythonstyle() method in Variable ?
invoke_function(ifunc, str, nullptr);
return;
}
@ -455,7 +455,7 @@ int PythonImpl::function_match(const char *name, const char *varname, int numeri
{
// NOTE to Richard - any reason not to put error messages here instead of in Variable class ?
// error messages appear 3x in Variable
int ifunc = find(name);
if (ifunc < 0) return -1;
if (pfuncs[ifunc].noutput == 0) return -2;
@ -481,7 +481,7 @@ int PythonImpl::wrapper_match(const char *name, const char *varname, int narg, i
{
// NOTE to Richard - any reason not to put 2 extra error messages here instead of in Variable class ?
// only this class knows the name of the missing internal var, so can generate better error message
int ifunc = function_match(name, varname, 1);
if (ifunc < 0) return ifunc;
@ -494,7 +494,7 @@ int PythonImpl::wrapper_match(const char *name, const char *varname, int narg, i
// in Python wrapper functions
// also set internal_var for use by invoke_function()
// so that invoke_function() is as fast as possible for args which are internal-style vars
int j = 0;
for (int i = 0; i < pfuncs[ifunc].ninput; i++)
if (pfuncs[ifunc].ivarflag[i] == INTERNALVAR) {
@ -503,7 +503,7 @@ int PythonImpl::wrapper_match(const char *name, const char *varname, int narg, i
pfuncs[ifunc].internal_var[i] = ivar;
argvars[j++] = ivar;
}
return ifunc;
}
@ -565,7 +565,7 @@ int PythonImpl::create_entry(char *name, int ninput, int noutput, int length_lon
char *vname = pfuncs[ifunc].svalue[i];
int ivar = input->variable->find(vname);
if (ivar < 0) { // create internal variable if does not exist
input->variable->internal_create(vname,0.0);
input->variable->internal_create(vname,0.0);
ivar = input->variable->find(vname);
}
if (!input->variable->internalstyle(ivar))
@ -585,7 +585,7 @@ int PythonImpl::create_entry(char *name, int ninput, int noutput, int length_lon
char *vname = pfuncs[ifunc].svalue[i];
int ivar = input->variable->find(vname);
if (ivar < 0) { // create internal variable if does not exist
input->variable->internal_create(vname,0.0);
input->variable->internal_create(vname,0.0);
ivar = input->variable->find(vname);
}
if (!input->variable->internalstyle(ivar))

View File

@ -109,7 +109,7 @@ ComputeAngleLocal::ComputeAngleLocal(LAMMPS *lmp, int narg, char **arg) :
if (tstr) {
tvar = input->variable->find(tstr);
if (tvar < 0) {
input->variable->internal_create(tstr,0.0);
input->variable->internal_create(tstr,0.0);
tvar = input->variable->find(tstr);
}
if (!input->variable->internalstyle(tvar))

View File

@ -155,7 +155,7 @@ ComputeBondLocal::ComputeBondLocal(LAMMPS *lmp, int narg, char **arg) :
if (dstr) {
dvar = input->variable->find(dstr);
if (dvar < 0) {
input->variable->internal_create(dstr,0.0);
input->variable->internal_create(dstr,0.0);
dvar = input->variable->find(dstr);
}
if (!input->variable->internalstyle(dvar))

View File

@ -103,7 +103,7 @@ ComputeDihedralLocal::ComputeDihedralLocal(LAMMPS *lmp, int narg, char **arg) :
if (pstr) {
pvar = input->variable->find(pstr);
if (pvar < 0) {
input->variable->internal_create(pstr,0.0);
input->variable->internal_create(pstr,0.0);
pvar = input->variable->find(pstr);
}
if (!input->variable->internalstyle(pvar))

View File

@ -393,7 +393,7 @@ void CreateAtoms::command(int narg, char **arg)
if (xstr) {
xvar = input->variable->find(xstr);
if (xvar < 0) {
input->variable->internal_create(xstr,0.0);
input->variable->internal_create(xstr,0.0);
xvar = input->variable->find(xstr);
}
if (!input->variable->internalstyle(xvar))
@ -402,7 +402,7 @@ void CreateAtoms::command(int narg, char **arg)
if (ystr) {
yvar = input->variable->find(ystr);
if (yvar < 0) {
input->variable->internal_create(ystr,0.0);
input->variable->internal_create(ystr,0.0);
yvar = input->variable->find(ystr);
}
if (!input->variable->internalstyle(yvar))
@ -411,7 +411,7 @@ void CreateAtoms::command(int narg, char **arg)
if (zstr) {
zvar = input->variable->find(zstr);
if (zvar < 0) {
input->variable->internal_create(zstr,0.0);
input->variable->internal_create(zstr,0.0);
zvar = input->variable->find(zstr);
}
if (!input->variable->internalstyle(zvar))

View File

@ -869,7 +869,7 @@ void FixDeposit::options(int narg, char **arg)
if (xstr) {
xvar = input->variable->find(xstr);
if (xvar < 0) {
input->variable->internal_create(xstr,0.0);
input->variable->internal_create(xstr,0.0);
xvar = input->variable->find(xstr);
}
if (!input->variable->internalstyle(xvar))
@ -878,7 +878,7 @@ void FixDeposit::options(int narg, char **arg)
if (ystr) {
yvar = input->variable->find(ystr);
if (yvar < 0) {
input->variable->internal_create(ystr,0.0);
input->variable->internal_create(ystr,0.0);
yvar = input->variable->find(ystr);
}
if (!input->variable->internalstyle(yvar))
@ -887,7 +887,7 @@ void FixDeposit::options(int narg, char **arg)
if (zstr) {
zvar = input->variable->find(zstr);
if (zvar < 0) {
input->variable->internal_create(zstr,0.0);
input->variable->internal_create(zstr,0.0);
zvar = input->variable->find(zstr);
}
if (!input->variable->internalstyle(zvar))

View File

@ -4223,7 +4223,7 @@ int Variable::math_function(char *word, char *contents, Tree **tree, Tree **tree
data[ivar][0],names[ivar]);
}
}
// if tree: store python variable and arg info in tree for later eval
// else: one-time eval of python-coded function now via python variable