clipper::SFcalc_obs_base< T > Class Template Reference
Base class for structure factor calculation vs observed methods. More...
#include <function_object_bases.h>
Inheritance diagram for clipper::SFcalc_obs_base< T >:
Public Member Functions | |
| virtual bool | operator() (HKL_data< datatypes::F_phi< T > > &fphi, const HKL_data< datatypes::F_sigF< T > > &fsig, const Atom_list &atoms)=0 |
| Structure factor calculation function definition. | |
| virtual | ~SFcalc_obs_base () |
| destructor | |
Detailed Description
template<class T>
class clipper::SFcalc_obs_base< T >
Base class for structure factor calculation vs observed methods.
Member Function Documentation
template<class T >
| virtual bool clipper::SFcalc_obs_base< T >::operator() | ( | HKL_data< datatypes::F_phi< T > > & | fphi, | |
| const HKL_data< datatypes::F_sigF< T > > & | fsig, | |||
| const Atom_list & | atoms | |||
| ) | [pure virtual] |
Structure factor calculation function definition.
In the implementations, this function will do the actual structure factor calculation.
- Parameters:
-
fphidata Fourier coefficients to be calculated. On output this holds the Fourier coefficients corresponding to the atomic model. fo Observed data against which to reference the Fcalc, e.g. to fit scale and/or bulk solvent. atoms The atom selection from which the density is to be calculated.
- Returns:
- true on success.
Implemented in clipper::SFcalc_obs_bulk< T >.
The documentation for this class was generated from the following file:
