| 97 |
|
}; |
| 98 |
|
|
| 99 |
|
|
| 100 |
< |
class TraPPE_ExFF : public ForceFields{ |
| 100 |
> |
class DUFF : public ForceFields{ |
| 101 |
|
|
| 102 |
|
public: |
| 103 |
< |
TraPPE_ExFF(); |
| 104 |
< |
virtual ~TraPPE_ExFF(); |
| 103 |
> |
DUFF(); |
| 104 |
> |
virtual ~DUFF(); |
| 105 |
|
|
| 106 |
|
void readParams(); |
| 107 |
|
void cleanMe( void ); |
| 121 |
|
void fastForward( char* stopText, char* searchOwner ); |
| 122 |
|
}; |
| 123 |
|
|
| 124 |
< |
class LJ_FF : public ForceFields{ |
| 124 |
> |
class LJFF : public ForceFields{ |
| 125 |
|
|
| 126 |
|
public: |
| 127 |
< |
LJ_FF(); |
| 128 |
< |
virtual ~LJ_FF(); |
| 127 |
> |
LJFF(); |
| 128 |
> |
virtual ~LJFF(); |
| 129 |
|
|
| 130 |
|
|
| 131 |
|
void readParams(); |
| 146 |
|
void fastForward( char* stopText, char* searchOwner ); |
| 147 |
|
|
| 148 |
|
}; |
| 149 |
+ |
|
| 150 |
|
class EAM_FF : public ForceFields{ |
| 151 |
|
|
| 152 |
|
public: |