IMP Reference Guide
develop.63b38c487d,2024/12/22
The Integrative Modeling Platform
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#include <IMP/multi_state/SAXSMultiStateModelScore.h>
Score multi-state models against SAXS profiles
Definition at line 26 of file SAXSMultiStateModelScore.h.
Public Member Functions | |
SAXSMultiStateModelScore (const saxs::Profiles &profiles, const saxs::Profile *exp_profile, bool c1_c2_approximate, double min_c1=0.99, double max_c1=1.05, double min_c2=-0.5, double max_c2=2.0, bool use_offset=false) | |
double | get_average_c1 () const |
double | get_average_c2 () const |
std::string | get_dataset_name () const override |
saxs::WeightedFitParameters | get_fit_parameters (MultiStateModel &m) const override |
saxs::WeightedFitParameters | get_fit_parameters () const override |
double | get_score (const MultiStateModel &m) const override |
double | get_score (const MultiStateModel &m, Vector< double > &weights) const override |
std::string | get_state_name (unsigned int id) const override |
void | set_average_c1_c2 (const Vector< saxs::WeightedFitParameters > &fps) |
void | write_fit_file (MultiStateModel &m, const saxs::WeightedFitParameters &fp, const std::string fit_file_name) const override |