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small tweaks to support type labels with single and double quotes. add tests

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This commit is contained in:
Axel Kohlmeyer
2022-09-03 19:04:24 -04:00
parent b143f87d10
commit bb45137b1a
4 changed files with 14 additions and 4 deletions
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src/atom.cpp
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@ -1834,8 +1834,8 @@ void Atom::set_mass(const char *file, int line, int /*narg*/, char **arg)
{
if (mass == nullptr) error->all(file,line, "Cannot set atom mass for atom style {}", atom_style);
if (!isdigit(arg[0][0]) && arg[0][0] != '*') {
std::string typestr(arg[0]);
std::string typestr = utils::trim(arg[0]);
if (!isdigit(typestr[0]) && typestr[0] != '*') {
int itype = lmap->find(typestr,Atom::ATOM);
if (itype == -1) error->all(file,line,"Invalid type for mass set");
mass[itype] = utils::numeric(FLERR,arg[1],false,lmp);