| 19 | } |
| 20 | |
| 21 | std::string normalizeAtomSymbol(std::string value) { |
| 22 | value = lowercase(std::move(value)); |
| 23 | if (!value.empty()) { |
| 24 | value[0] = static_cast<char>(std::toupper(static_cast<unsigned char>(value[0]))); |
| 25 | } |
| 26 | return value; |
| 27 | } |
| 28 | |
| 29 | std::optional<AtomData::Type> findAtomTypeBySymbol(std::string_view speciesName) { |
| 30 | const std::string atomSymbol = normalizeAtomSymbol(std::string(speciesName)); |
no test coverage detected