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Rosetta Protocols
2014.35
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helper class for the MatcherMover that will put a match into a supplied pose More...
#include <PDBWriter.hh>
Public Types | |
typedef CloudPDBWriter | parent |
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typedef PDBWriter | parent |
typedef utility::vector1 < std::set< upstream_hit > > | UpstreamHitSets |
typedef utility::vector1 < std::set< downstream_hit > > | DownstreamHitSets |
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typedef std::pair< core::Size, core::Size > | SizePair |
typedef OutputWriter | Parent |
Public Member Functions | |
PoseMatchOutputWriter (MatchGrouperOP grouper) | |
~PoseMatchOutputWriter () | |
void | insert_match_into_pose (core::pose::Pose &pose, core::Size match_group) |
void | insert_match_into_pose (core::pose::Pose &pose) |
void | end_output_writing () |
this function doesn't do anything, but needs to exist to suppress the unwanted call to the base class function More... | |
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CloudPDBWriter (MatchGrouperOP grouper) | |
virtual | ~CloudPDBWriter () |
virtual void | prepare_for_output_writing () |
virtual void | record_match (match const &m, MatchEvaluatorOP evaluator, MatchScoreWriterOP match_score_writer) |
no writing in this function, only saving the hits according to what group they belong to More... | |
virtual void | record_match (match_dspos1 const &m) |
evaluator and score writer are not passed in because single-downstream-position match currently have no way of being evaluated More... | |
void | write_match_groups () |
this is where the actual writing happens More... | |
utility::vector1 < UpstreamHitSets > const & | match_groups_ushits () const |
utility::vector1 < DownstreamHitSets > const & | match_groups_dshits () const |
utility::vector1< match_dspos1 > const & | representative_group_matches () const |
utility::vector1< std::set < downstream_hit > ::const_iterator > const & | ds_hitset_its () const |
utility::vector1< std::set < downstream_hit > ::const_iterator > const & | ds_hitset_end_its () const |
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PDBWriter () | |
virtual | ~PDBWriter () |
void | set_coordinate_cacher (UpstreamHitCacherOP) |
void | set_prefix (std::string const &prefix) |
void | initialize_from_matcher_task (MatcherTaskCOP mtask) |
void | set_downstream_builder (Size geomcst_id, downstream::DownstreamBuilderCOP dsbuilder) |
void | assemble_remark_lines (core::pose::Pose &outpose, utility::vector1< core::conformation::ResidueCOP > const &upstream_matchres, std::map< core::Size, core::Size > const &redundant_upstream_res, utility::vector1< core::Size > const &ex_geom_ids_for_upstream_res) const |
core::pose::PoseCOP | create_output_upstream_pose (utility::vector1< core::conformation::ResidueCOP > const &upstream_matchres, std::map< core::Size, core::Size > const &redundant_upstream_res, utility::vector1< core::Size > const &ex_geom_ids_for_upstream_res) |
std::string | signature_string (utility::vector1< core::conformation::ResidueCOP > const &upstream_matchres) const |
core::Size | num_geom_cst () const |
std::string | scaf_name () const |
std::string | cstfile_name () const |
std::string | prefix () const |
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OutputWriter () | |
virtual | ~OutputWriter () |
protocols::toolbox::match_enzdes_util::EnzConstraintIOCOP | cst_io () const |
void | determine_redundant_upstream_matchres (match_dspos1 const &m, std::map< core::Size, core::Size > &redundant_upstream_res) const |
determine if any upstream res are at the same scaffold position, i.e. if one of them is a backbone interaction the redundant_upstream_res map is a mapping from the redundant geometric constraint id of the redundant residue to the geomcst_id of the "nonredundant" res i.e. if cstres 1 happens to be a cys at position 10 and cstres 3 is a gly at position 10 (and it's backbone is used in satisfying constraint 3), the mapping will contain the 3,1 pair. More... | |
Additional Inherited Members | |
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void | setup_hitset_iterators_for_group (core::Size const group) |
void | clear_match_data () |
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UpstreamHitCacherOP | coordinate_cacher () |
utility::vector1 < downstream::DownstreamBuilderCOP > const & | dsbuilders () |
std::string | assemble_outtag (utility::vector1< core::conformation::ResidueCOP > const &upstream_matchres) |
helper class for the MatcherMover that will put a match into a supplied pose
protocols::match::output::PoseMatchOutputWriter::PoseMatchOutputWriter | ( | MatchGrouperOP | grouper | ) |
protocols::match::output::PoseMatchOutputWriter::~PoseMatchOutputWriter | ( | ) |
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virtual |
this function doesn't do anything, but needs to exist to suppress the unwanted call to the base class function
Reimplemented from protocols::match::output::CloudPDBWriter.
void protocols::match::output::PoseMatchOutputWriter::insert_match_into_pose | ( | core::pose::Pose & | pose, |
core::Size | match_group | ||
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References core::pose::Pose::append_residue_by_jump(), protocols::match::output::PDBWriter::assemble_remark_lines(), begin, protocols::match::output::PDBWriter::coordinate_cacher(), protocols::match::output::OutputWriter::determine_redundant_upstream_matchres(), protocols::match::output::PDBWriter::dsbuilders(), end, protocols::match::fake_hit(), protocols::match::full_hit(), protocols::toolbox::match_enzdes_util::get_enzdes_observer(), protocols::match::output::CloudPDBWriter::match_groups_dshits(), protocols::match::output::PDBWriter::num_geom_cst(), protocols::match::match_dspos1::originating_geom_cst_for_dspos, core::pose::Pose::pdb_info(), core::pose::Pose::replace_residue(), protocols::match::output::CloudPDBWriter::representative_group_matches(), residue, core::pose::Pose::total_residue(), protocols::match::match_dspos1::upstream_hits, and utility_exit_with_message.
Referenced by insert_match_into_pose().
void protocols::match::output::PoseMatchOutputWriter::insert_match_into_pose | ( | core::pose::Pose & | pose | ) |