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core::init::pre_talaris_2013_behavior_settings Struct Reference

Public Member Functions

 pre_talaris_2013_behavior_settings ()
 

Public Attributes

bool pre_talaris2013_geometries { true }
 
bool hb_sp2_chipen { false }
 
bool hb_fade_energy { false }
 
bool hbond_measure_sp3acc_BAH_from_hvy { false }
 
Real lj_hbond_hdis = 1.95
 
Real lj_hbond_OH_donor_dis = 3.0
 
Real hb_sp2_outer_width = 0.33333
 
Real expand_st_chi2sampling { false }
 
std::string score_weights
 
std::string score_patch
 
bool analytic_etable_evaluation { false }
 
std::string hbond_params
 
bool smooth_fa_elec { false }
 
Real elec_min_dis = 1.5
 
bool dun10 { false }
 
bool use_bicubic_interpolation { false }
 

Constructor & Destructor Documentation

core::init::pre_talaris_2013_behavior_settings::pre_talaris_2013_behavior_settings ( )

Member Data Documentation

bool core::init::pre_talaris_2013_behavior_settings::analytic_etable_evaluation { false }
bool core::init::pre_talaris_2013_behavior_settings::dun10 { false }
Real core::init::pre_talaris_2013_behavior_settings::elec_min_dis = 1.5
Real core::init::pre_talaris_2013_behavior_settings::expand_st_chi2sampling { false }
bool core::init::pre_talaris_2013_behavior_settings::hb_fade_energy { false }
bool core::init::pre_talaris_2013_behavior_settings::hb_sp2_chipen { false }
Real core::init::pre_talaris_2013_behavior_settings::hb_sp2_outer_width = 0.33333
bool core::init::pre_talaris_2013_behavior_settings::hbond_measure_sp3acc_BAH_from_hvy { false }
std::string core::init::pre_talaris_2013_behavior_settings::hbond_params
Real core::init::pre_talaris_2013_behavior_settings::lj_hbond_hdis = 1.95
Real core::init::pre_talaris_2013_behavior_settings::lj_hbond_OH_donor_dis = 3.0
bool core::init::pre_talaris_2013_behavior_settings::pre_talaris2013_geometries { true }
std::string core::init::pre_talaris_2013_behavior_settings::score_patch
std::string core::init::pre_talaris_2013_behavior_settings::score_weights
bool core::init::pre_talaris_2013_behavior_settings::smooth_fa_elec { false }
bool core::init::pre_talaris_2013_behavior_settings::use_bicubic_interpolation { false }

The documentation for this struct was generated from the following file: