| 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). |
| 39 |
< |
* [4] Vardeman & Gezelter, in progress (2009). |
| 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 |
|
*/ |
| 42 |
|
|
| 43 |
|
#include <functional> |
| 61 |
|
return result; |
| 62 |
|
} |
| 63 |
|
|
| 63 |
– |
|
| 64 |
– |
|
| 64 |
|
template<typename T> |
| 65 |
< |
struct logical_xor :public std::binary_function<T, T, bool> { |
| 66 |
< |
RealType operator()(T x, T y) { return x ^ y; } |
| 65 |
> |
struct logical_xor : public std::binary_function<T, T, bool> { |
| 66 |
> |
T operator()(const T& x, const T& y) { return x ^ y; } |
| 67 |
|
}; |
| 68 |
< |
|
| 68 |
> |
|
| 69 |
> |
template<typename T> |
| 70 |
> |
struct to_bool : public std::unary_function<T, bool> { |
| 71 |
> |
bool operator()(const T& x) const { |
| 72 |
> |
return x != 0; |
| 73 |
> |
} |
| 74 |
> |
}; |
| 75 |
|
} |
| 76 |
+ |
|
| 77 |
+ |
|
