Rosetta 3.5
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#include <ResidueConformationFeatures.hh>
Public Member Functions | |
ResidueConformationFeatures () | |
ResidueConformationFeatures (ResidueConformationFeatures const &) | |
virtual | ~ResidueConformationFeatures () |
virtual void | write_schema_to_db (utility::sql_database::sessionOP db_session) const |
generate the table schemas and write them to the database More... | |
utility::vector1< std::string > | features_reporter_dependencies () const |
return the set of features reporters that are required to also already be extracted by the time this one is used. More... | |
std::string | type_name () const |
return string with class name More... | |
core::Size | report_features (core::pose::Pose const &pose, utility::vector1< bool > const &relevant_residues, boost::uuids::uuid struct_id, utility::sql_database::sessionOP db_session) |
collect all the feature data for the pose More... | |
void | delete_record (boost::uuids::uuid struct_id, utility::sql_database::sessionOP) |
void | load_into_pose (utility::sql_database::sessionOP db_session, boost::uuids::uuid struct_id, core::pose::Pose &pose) |
void | load_conformation (utility::sql_database::sessionOP db_session, boost::uuids::uuid struct_id, core::pose::Pose &pose) |
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virtual | ~FeaturesReporter () |
Automatically generated virtual destructor for class deriving directly from ReferenceCount. More... | |
virtual std::string | schema () const |
return sql statements that sets up the appropriate tables to contain the features. This should be removed once everything has been moved to the schema generator More... | |
core::Size | report_features (core::pose::Pose const &, boost::uuids::uuid, utility::sql_database::sessionOP) |
collect all the feature data for the pose. More... | |
virtual void | parse_my_tag (utility::tag::TagPtr const tag, protocols::moves::DataMap &, protocols::filters::Filters_map const &, protocols::moves::Movers_map const &, core::pose::Pose const &) |
Private Member Functions | |
void | set_coords_for_residue (utility::sql_database::sessionOP db_session, boost::uuids::uuid struct_id, core::Size seqpos, core::pose::Pose &pose) |
Additional Inherited Members | |
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std::string | find_tag (core::pose::Pose const &pose) const |
void | delete_records_from_table (std::string const &table_name, boost::uuids::uuid struct_id, utility::sql_database::sessionOP db_session) |
a helper function for deleting data associated with a given structure from feature database WARNING table_name must be sanitized! More... | |
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inline |
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inlinevirtual |
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Reimplemented from protocols::features::FeaturesReporter.
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return the set of features reporters that are required to also already be extracted by the time this one is used.
Reimplemented from protocols::features::FeaturesReporter.
void protocols::features::ResidueConformationFeatures::load_conformation | ( | utility::sql_database::sessionOP | db_session, |
boost::uuids::uuid | struct_id, | ||
core::pose::Pose & | pose | ||
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References core::pose::Pose::is_fullatom(), core::chemical::ResidueType::is_protein(), core::scoring::omega, protocols::swa::phi(), protocols::swa::psi(), core::pose::Pose::residue_type(), core::pose::Pose::set_chi(), set_coords_for_residue(), core::pose::Pose::set_omega(), core::pose::Pose::set_phi(), and core::pose::Pose::set_psi().
Referenced by load_into_pose().
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Reimplemented from protocols::features::FeaturesReporter.
References load_conformation().
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collect all the feature data for the pose
Implements protocols::features::FeaturesReporter.
References core::conformation::Residue::aa(), core::conformation::Residue::chi(), core::pose::Pose::conformation(), core::conformation::is_ideal_position(), core::conformation::Residue::is_ligand(), core::conformation::Residue::mainchain_torsion(), core::pose::Pose::n_residue(), core::conformation::Residue::natoms(), core::conformation::Residue::nchi(), core::chemical::num_canonical_aas, core::scoring::omega, protocols::swa::phi(), protocols::swa::psi(), core::pose::Pose::residue(), core::pose::Pose::total_residue(), and core::conformation::Residue::xyz().
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References core::pose::Pose::set_xyz().
Referenced by load_conformation().
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return string with class name
Reimplemented from protocols::features::FeaturesReporter.
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generate the table schemas and write them to the database
Implements protocols::features::FeaturesReporter.
References core::scoring::omega, protocols::swa::phi(), and protocols::swa::psi().