| 35 |
|
* |
| 36 |
|
* [1] Meineke, et al., J. Comp. Chem. 26, 252-271 (2005). |
| 37 |
|
* [2] Fennell & Gezelter, J. Chem. Phys. 124, 234104 (2006). |
| 38 |
< |
* [3] Sun, Lin & Gezelter, J. Chem. Phys. 128, 24107 (2008). |
| 38 |
> |
* [3] Sun, Lin & Gezelter, J. Chem. Phys. 128, 234107 (2008). |
| 39 |
|
* [4] Kuang & Gezelter, J. Chem. Phys. 133, 164101 (2010). |
| 40 |
|
* [5] Vardeman, Stocker & Gezelter, J. Chem. Theory Comput. 7, 834 (2011). |
| 41 |
|
*/ |
| 119 |
|
// ltoken.push_back(Token(Token::string, str)); |
| 120 |
|
// continue; |
| 121 |
|
//} |
| 122 |
< |
if (lookingAtDecimal((tokCommand & Token::negnums) != 0)) { |
| 122 |
> |
//if (lookingAtDecimal((tokCommand & Token::negnums) != 0)) { |
| 123 |
> |
if (lookingAtDecimal((tokCommand) != 0)) { |
| 124 |
|
float value = lexi_cast<float>(script.substr(ichToken, cchToken)); |
| 125 |
|
ltoken.push_back(Token(Token::decimal, boost::any(value))); |
| 126 |
|
continue; |
| 127 |
|
} |
| 128 |
< |
if (lookingAtInteger((tokCommand & Token::negnums) != 0)) { |
| 128 |
> |
//if (lookingAtInteger((tokCommand & Token::negnums) != 0)) { |
| 129 |
> |
if (lookingAtInteger((tokCommand) != 0)) { |
| 130 |
|
|
| 131 |
|
int val = lexi_cast<int>(script.substr(ichToken, cchToken)); |
| 132 |
|
ltoken.push_back(Token(Token::integer, boost::any(val))); |
| 179 |
|
continue; |
| 180 |
|
} |
| 181 |
|
|
| 182 |
< |
if (ltoken.size() == 0) { |
| 182 |
> |
if (ltoken.empty()) { |
| 183 |
|
return commandExpected(); |
| 184 |
|
} |
| 185 |
|
|