| 13 |
|
extern void set_interface_stamps( MakeStamps* ms, Globals* g ); |
| 14 |
|
|
| 15 |
|
string getPrefix(const string& str ){ |
| 16 |
< |
string prefix = str; |
| 16 |
> |
string prefix; |
| 17 |
> |
string suffix; |
| 18 |
|
int pos; |
| 19 |
|
|
| 20 |
< |
pos = prefix.rfind("."); |
| 21 |
< |
return prefix.substr(0, pos); |
| 20 |
> |
pos = str.rfind("."); |
| 21 |
> |
|
| 22 |
> |
if (pos >= 0) { |
| 23 |
> |
prefix = str.substr(0, pos); |
| 24 |
> |
suffix = str.substr(pos, str.size()); |
| 25 |
> |
|
| 26 |
> |
// leave .bass there in case we've reverted to old habits |
| 27 |
> |
if (!strcasecmp(suffix.c_str()), ".md") || !strcasecmp(suffix.c_str(), ".bass")) |
| 28 |
> |
return prefix; |
| 29 |
> |
else |
| 30 |
> |
return str; |
| 31 |
> |
|
| 32 |
> |
} else |
| 33 |
> |
return str; |
| 34 |
|
}; |
| 35 |
|
|
| 36 |
|
class SimSetup{ |
| 74 |
|
|
| 75 |
|
#endif //is_mpi |
| 76 |
|
|
| 77 |
< |
void initFromBass( void ); |
| 77 |
> |
void initFromMetaDataFile( void ); |
| 78 |
|
void makeMolecules( void ); |
| 79 |
|
void makeElement( double x, double y, double z ); |
| 80 |
|
|
