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Rosetta 3.5
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Namespaces | |
| nonlocal | |
| quota | |
| scores | |
Classes | |
| class | BestTotalScoreSelector |
| selects a given number of fragments using a quota scheme More... | |
| class | BoundedPriorityQueue |
| class | BoundedCollector |
| Keeps the N best fragments candidates for the final selection. More... | |
| class | BoundedCollector_CompareTotalScore |
| class | CandidatesCollector |
| A base class for collecting fragments. More... | |
| class | CompareQueryPosition |
| comparator based on a sequence position in a query More... | |
| class | CompareTotalScore |
| comparator based on the total score of fragments More... | |
| class | CompareByScoreCombination |
| comparator based on the linear combination of some score components More... | |
| class | CompareScoreComponent |
| comparator based on one of the score components calculated for fragments More... | |
| class | CompositeFragmentSelector |
| selects fragments by running several selectors More... | |
| class | Contact |
| class | ContactCounts |
| class | CS2ndShift |
| class | CSTalosIO |
| class | CustomScoreSelector |
| selects a given number of fragments using a quota scheme More... | |
| class | DiversifyCrmsdByClustering |
| selects fragments by running several selectors More... | |
| class | DiversifyCrmsdSelector |
| selects fragments by running several selectors More... | |
| class | DiversifyDihedralsSelector |
| selects fragments by running several selectors More... | |
| class | FragmentCandidate |
| Vector candidate says which X-mer from vall fits to a query sequence. More... | |
| class | FragmentComparatorBase |
| class | QuotaDebug |
| class | FragmentPicker |
| The core of the fragment picking machinery. More... | |
| class | FragmentSelectingRule |
| selects a given number of fragments just by selecting the best ones More... | |
| class | GrabAllCollector |
| Keeps all fragments candidates for the final selection. More... | |
| class | JCouplingIO |
| class | LAMBEGO_IO |
| class | LazySortedVector1 |
| class | PdbIdChunkFilter |
| class | AllowPdbIdFilter |
| Accepts a chunk based on the pdb id of the source protein. More... | |
| class | DenyPdbIdFilter |
| Denies a chunk based on the pdb id of the source protein. More... | |
| class | PhiPsiTalosIO |
| class | SidechainContactDistCutoff |
| defines sidechain contact distance cutoffs. More... | |
| class | TorsionBinIO |
| class | VallChunk |
| represents a chunk of residues extracted from a vall. More... | |
| class | VallChunkFilter |
| a base class for a chunk filtering mechanism More... | |
| class | VallProvider |
| a vector of vall chunks More... | |
| class | VallResidue |
| class for managing a line of the Vall fragment library More... | |
Enumerations | |
| enum | ContactType { CA =1, CB, CEN, UNK, num_contact_types = UNK } |
Functions | |
| static basic::Tracer | trBestTotalScoreSelector ("protocols.frag_picker.BestTotalScoreSelector") |
| std::map< std::string, ContactType > | setup_name2type () |
| BEGIN: local functions. More... | |
| std::map< std::string, ContactType > & | name2type () |
| map that converts string name to enum More... | |
| utility::vector1< std::string > | setup_type2name () |
| setup the vector that maps enum to string name More... | |
| utility::vector1< std::string > & | type2name () |
| vector that maps enum to string name More... | |
| ContactType | contact_type (std::string const &name) |
| END: local functions. More... | |
| std::string | contact_name (ContactType type) |
| give an enum type and return the string name More... | |
| static basic::Tracer | tr ("protocols.frag_picker.SecondaryShiftCalculator") |
| static basic::Tracer | tr ("protocols.frag_picker.TalosReader") |
| static basic::Tracer | trCustomScoreSelector ("protocols.frag_picker.CustomScoreSelector") |
| bool | sort_function (ExtraScoreVector::value_type p1, ExtraScoreVector::value_type p2) |
| static basic::Tracer | trDiversifyCrmsdByClustering ("protocols.frag_picker.DiversifyCrmsdByClustering") |
| static basic::Tracer | trDiversifyCrmsdSelector ("protocols.frag_picker.DiversifyCrmsdSelector") |
| static basic::Tracer | trDiversifyDihedralsSelector ("protocols.frag_picker.DiversifyDihedralsSelector") |
| std::map< char, core::Real > | setup_faraggi_map () |
| setup the faraggi SA max map, see Faraggi et al. Proteins 2008 More... | |
| std::map< char, core::Real > & | sa_faraggi_max () |
| faraggi SA max map More... | |
| core::Real | sa_faraggi_max (char aa) |
| static basic::Tracer | trFragmentCandidate ("protocols.frag_picker.FragmentCandidate") |
| utility::vector1 < FragmentCandidateOP > | read_fragment_candidates (std::string file_name, VallProviderOP chunk_owner, Size max_nfrags_per_pos) |
| std::ostream & | operator<< (std::ostream &out, FragmentCandidate const &fr) |
| std::ostream & | operator<< (std::ostream &out, std::pair< FragmentCandidateOP, scores::FragmentScoreMapOP > const &pair) |
| static basic::Tracer | tr ("protocols.frag_picker.FragmentPicker") |
| static basic::Tracer | trJCouplingIO ("protocols.frag_picker.TalosReader") |
| static basic::Tracer | tracer ("protocols.frag_picker.LAMBEGO_IO") |
| static basic::Tracer | trPdbFilter ("protocols.frag_picker.PdbIdChunkFilter") |
| static basic::Tracer | tr ("protocols.frag_picker.PhiPsiTalosIO") |
| static basic::Tracer | TR ("protocols.frag_picker.SidechainContactDistCutoff") |
| static basic::Tracer | tracer ("protocols.frag_picker.TorsionBinIO") |
| static basic::Tracer | TR ("protocols.frag_picker.VallResidue") |
| typedef utility::pointer::owning_ptr<AllowPdbIdFilter const> protocols::frag_picker::AllowPdbIdFilterCOP |
Definition at line 35 of file PdbIdChunkFilter.fwd.hh.
Definition at line 33 of file PdbIdChunkFilter.fwd.hh.
| typedef utility::pointer::owning_ptr<BestTotalScoreSelector const> protocols::frag_picker::BestTotalScoreSelectorCOP |
Definition at line 29 of file BestTotalScoreSelector.fwd.hh.
| typedef utility::pointer::owning_ptr<BestTotalScoreSelector> protocols::frag_picker::BestTotalScoreSelectorOP |
Definition at line 24 of file BestTotalScoreSelector.fwd.hh.
| typedef std::pair<FragmentCandidateOP, scores::FragmentScoreMapOP> protocols::frag_picker::Candidate |
Definition at line 58 of file FragmentPicker.hh.
Definition at line 59 of file FragmentPicker.hh.
| typedef utility::pointer::owning_ptr<CandidatesCollector const> protocols::frag_picker::CandidatesCollectorCOP |
Definition at line 29 of file CandidatesCollector.fwd.hh.
| typedef utility::pointer::owning_ptr<CandidatesCollector> protocols::frag_picker::CandidatesCollectorOP |
Definition at line 25 of file CandidatesCollector.fwd.hh.
| typedef std::map<Size, CandidatesCollectorOP> protocols::frag_picker::CandidatesSink |
Definition at line 60 of file FragmentPicker.hh.
| typedef utility::pointer::owning_ptr<CompareQueryPosition const> protocols::frag_picker::CompareQueryPositionCOP |
Definition at line 29 of file CommonFragmentComparators.fwd.hh.
| typedef utility::pointer::owning_ptr<CompareQueryPosition> protocols::frag_picker::CompareQueryPositionOP |
Definition at line 26 of file CommonFragmentComparators.fwd.hh.
| typedef utility::pointer::owning_ptr<CompareScoreComponent const> protocols::frag_picker::CompareScoreComponentCOP |
Definition at line 35 of file CommonFragmentComparators.fwd.hh.
| typedef utility::pointer::owning_ptr<CompareScoreComponent> protocols::frag_picker::CompareScoreComponentOP |
Definition at line 34 of file CommonFragmentComparators.fwd.hh.
| typedef utility::pointer::owning_ptr<CompareTotalScore const> protocols::frag_picker::CompareTotalScoreCOP |
Definition at line 32 of file CommonFragmentComparators.fwd.hh.
Definition at line 31 of file CommonFragmentComparators.fwd.hh.
Definition at line 28 of file Contact.fwd.hh.
Definition at line 28 of file ContactCounts.fwd.hh.
Definition at line 25 of file ContactCounts.fwd.hh.
Definition at line 25 of file Contact.fwd.hh.
| typedef utility::pointer::owning_ptr<CustomScoreSelector const> protocols::frag_picker::CustomScoreSelectorCOP |
Definition at line 29 of file CustomScoreSelector.fwd.hh.
| typedef utility::pointer::owning_ptr<CustomScoreSelector> protocols::frag_picker::CustomScoreSelectorOP |
Definition at line 24 of file CustomScoreSelector.fwd.hh.
| typedef utility::pointer::owning_ptr<DenyPdbIdFilter const> protocols::frag_picker::DenyPdbIdFilterCOP |
Definition at line 38 of file PdbIdChunkFilter.fwd.hh.
Definition at line 37 of file PdbIdChunkFilter.fwd.hh.
| typedef utility::vector1<std::pair< ScoredCandidate, core::Real> > protocols::frag_picker::ExtraScoreVector |
Definition at line 32 of file CustomScoreSelector.cc.
| typedef utility::pointer::owning_ptr<FragmentCandidate const> protocols::frag_picker::FragmentCandidateCOP |
Definition at line 32 of file FragmentCandidate.fwd.hh.
Definition at line 29 of file FragmentCandidate.fwd.hh.
| typedef utility::pointer::owning_ptr<FragmentComparatorBase const> protocols::frag_picker::FragmentComparatorBaseCOP |
Definition at line 27 of file FragmentComparatorBase.fwd.hh.
| typedef utility::pointer::owning_ptr<FragmentComparatorBase> protocols::frag_picker::FragmentComparatorBaseOP |
Definition at line 24 of file FragmentComparatorBase.fwd.hh.
| typedef utility::pointer::owning_ptr<FragmentPicker const> protocols::frag_picker::FragmentPickerCOP |
Definition at line 27 of file FragmentPicker.fwd.hh.
Definition at line 24 of file FragmentPicker.fwd.hh.
| typedef utility::pointer::owning_ptr<FragmentSelectingRule const> protocols::frag_picker::FragmentSelectingRuleCOP |
Definition at line 29 of file FragmentSelectingRule.fwd.hh.
| typedef utility::pointer::owning_ptr<FragmentSelectingRule> protocols::frag_picker::FragmentSelectingRuleOP |
Definition at line 24 of file FragmentSelectingRule.fwd.hh.
| typedef utility::pointer::owning_ptr< GrabAllCollector const > protocols::frag_picker::GrabAllCollectorCOP |
Definition at line 39 of file GrabAllCollector.hh.
Definition at line 37 of file GrabAllCollector.hh.
| typedef utility::pointer::owning_ptr<PdbIdChunkFilter const> protocols::frag_picker::PdbIdChunkFilterCOP |
Definition at line 31 of file PdbIdChunkFilter.fwd.hh.
Definition at line 27 of file PdbIdChunkFilter.fwd.hh.
| typedef std::pair<Size,Size> protocols::frag_picker::PosPair |
Definition at line 57 of file FragmentPicker.hh.
| typedef std::pair<FragmentCandidateOP, scores::FragmentScoreMapOP> protocols::frag_picker::ScoredCandidate |
Definition at line 33 of file FragmentCandidate.fwd.hh.
Definition at line 34 of file FragmentCandidate.fwd.hh.
| typedef utility::pointer::owning_ptr<SidechainContactDistCutoff const> protocols::frag_picker::SidechainContactDistCutoffCOP |
Definition at line 23 of file SidechainContactDistCutoff.fwd.hh.
| typedef utility::pointer::owning_ptr<SidechainContactDistCutoff> protocols::frag_picker::SidechainContactDistCutoffOP |
Definition at line 21 of file SidechainContactDistCutoff.fwd.hh.
Definition at line 28 of file VallChunk.fwd.hh.
| typedef utility::pointer::owning_ptr<VallChunkFilter const> protocols::frag_picker::VallChunkFilterCOP |
Definition at line 28 of file VallChunkFilter.fwd.hh.
Definition at line 25 of file VallChunkFilter.fwd.hh.
Definition at line 25 of file VallChunk.fwd.hh.
Definition at line 30 of file VallProvider.fwd.hh.
Definition at line 31 of file VallProvider.fwd.hh.
Definition at line 28 of file VallProvider.fwd.hh.
Definition at line 25 of file VallProvider.fwd.hh.
Definition at line 28 of file VallResidue.fwd.hh.
Definition at line 25 of file VallResidue.fwd.hh.
| Enumerator | |
|---|---|
| CA | |
| CB | |
| CEN | |
| UNK | |
| num_contact_types | |
Definition at line 23 of file ContactTypes.hh.
| std::string protocols::frag_picker::contact_name | ( | ContactType | type) |
give an enum type and return the string name
Definition at line 84 of file ContactTypes.cc.
References num_contact_types, and type2name().
Referenced by protocols::frag_picker::FragmentPicker::fragment_contacts(), protocols::frag_picker::FragmentPicker::nonlocal_pairs(), protocols::frag_picker::nonlocal::NonlocalPair::print(), and protocols::frag_picker::Contact::type_name().
| ContactType protocols::frag_picker::contact_type | ( | std::string const & | name) |
END: local functions.
give a string name and return its enum type
Definition at line 72 of file ContactTypes.cc.
References core::sequence::end, and name2type().
Referenced by protocols::frag_picker::FragmentPicker::parse_command_line().
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map that converts string name to enum
Definition at line 42 of file ContactTypes.cc.
References setup_name2type().
Referenced by contact_type(), and setup_type2name().
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Definition at line 190 of file FragmentCandidate.hh.
References core::pack::dunbrack::c, and core::scoring::pair.
| utility::vector1< FragmentCandidateOP > protocols::frag_picker::read_fragment_candidates | ( | std::string | file_name, |
| VallProviderOP | chunk_owner, | ||
| Size | max_nfrags_per_pos | ||
| ) |
Definition at line 76 of file FragmentCandidate.cc.
References core::pack::dunbrack::c, and trFragmentCandidate().
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faraggi SA max map
Definition at line 76 of file Faraggi_SA.cc.
References setup_faraggi_map().
Referenced by protocols::frag_picker::VallResidue::fill_from_string_version1(), sa_faraggi_max(), and protocols::frag_picker::scores::SolventAccessibility::SolventAccessibility().
| core::Real protocols::frag_picker::sa_faraggi_max | ( | char | aa) |
Definition at line 84 of file Faraggi_SA.cc.
References core::sequence::end, and sa_faraggi_max().
| std::map< char, core::Real > protocols::frag_picker::setup_faraggi_map | ( | ) |
setup the faraggi SA max map, see Faraggi et al. Proteins 2008
Definition at line 30 of file Faraggi_SA.cc.
Referenced by sa_faraggi_max().
| std::map< std::string, ContactType > protocols::frag_picker::setup_name2type | ( | ) |
BEGIN: local functions.
setup the map that converts string name to enum
Definition at line 31 of file ContactTypes.cc.
References CA, CB, CEN, and UNK.
Referenced by name2type().
| utility::vector1< std::string > protocols::frag_picker::setup_type2name | ( | ) |
setup the vector that maps enum to string name
Definition at line 49 of file ContactTypes.cc.
References core::sequence::end, name2type(), and num_contact_types.
Referenced by type2name().
| bool protocols::frag_picker::sort_function | ( | ExtraScoreVector::value_type | p1, |
| ExtraScoreVector::value_type | p2 | ||
| ) |
Definition at line 34 of file CustomScoreSelector.cc.
Referenced by protocols::frag_picker::CustomScoreSelector::select_fragments().
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Referenced by protocols::frag_picker::VallProvider::cache_pose(), protocols::frag_picker::VallProvider::cache_profile(), protocols::frag_picker::VallProvider::find_chunk(), protocols::frag_picker::VallResidue::format_string(), protocols::frag_picker::VallResidue::format_string_cs(), protocols::frag_picker::VallResidue::format_string_residue_depth_version1(), protocols::frag_picker::VallResidue::format_string_version1(), protocols::frag_picker::SidechainContactDistCutoff::initialize(), and protocols::frag_picker::VallProvider::vallChunksFromLibrary().
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Referenced by protocols::frag_picker::FragmentPicker::bounded_protocol(), protocols::frag_picker::CS2ndShift::CS2ndShift(), protocols::frag_picker::FragmentPicker::is_valid_chunk(), protocols::frag_picker::FragmentPicker::keep_all_protocol(), protocols::frag_picker::FragmentPicker::nonlocal_pairs(), protocols::frag_picker::FragmentPicker::output_fragments(), protocols::frag_picker::FragmentPicker::parse_command_line(), protocols::frag_picker::FragmentPicker::pick_candidates(), protocols::frag_picker::FragmentPicker::quota_protocol(), protocols::frag_picker::CSTalosIO::read(), protocols::frag_picker::PhiPsiTalosIO::read(), protocols::frag_picker::CS2ndShift::read_adjust_table(), protocols::frag_picker::FragmentPicker::read_ss_files(), protocols::frag_picker::CS2ndShift::read_sslimit_table(), protocols::frag_picker::FragmentPicker::save_candidates(), protocols::frag_picker::FragmentPicker::save_fragments(), protocols::frag_picker::FragmentPicker::set_up_quota_nnmake_style(), protocols::frag_picker::FragmentPicker::set_up_ss_abego_quota(), and protocols::frag_picker::QuotaDebug::write_summary().
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Referenced by read_fragment_candidates().
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Referenced by protocols::frag_picker::JCouplingIO::read().
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vector that maps enum to string name
Definition at line 60 of file ContactTypes.cc.
References setup_type2name().
Referenced by contact_name().
1.8.4