X-Git-Url: http://woldlab.caltech.edu/gitweb/?a=blobdiff_plain;f=alg%2Fmussa.cpp;h=9a5935e19947cbd68e28e7c7a3f88b267816030f;hb=6d25d4d945af696134bdf788b111f38b197b1a15;hp=ccba221f61ca45a8007906046ccd2a07209eb510;hpb=3814f060a887355f15c923d3b3d1a9b322779832;p=mussa.git diff --git a/alg/mussa.cpp b/alg/mussa.cpp index ccba221..9a5935e 100644 --- a/alg/mussa.cpp +++ b/alg/mussa.cpp @@ -12,22 +12,20 @@ // ---------- mussa_class.cc ----------- // ---------------------------------------- +#include #include #include namespace fs = boost::filesystem; -#include -#include -#include -#include -namespace spirit = boost::spirit; - #include #include #include "mussa_exceptions.hpp" -#include "alg/mussa.hpp" -#include "alg/flp.hpp" + +#include "flp.hpp" +#include "io.hpp" +#include "mussa.hpp" +#include "motif_parser.hpp" using namespace std; @@ -36,8 +34,8 @@ Mussa::Mussa() : color_mapper(new AnnotationColors) { clear(); - connect(&the_paths, SIGNAL(progress(const std::string&, int, int)), - this, SIGNAL(progress(const std::string&, int, int))); + connect(&the_paths, SIGNAL(progress(const QString&, int, int)), + this, SIGNAL(progress(const QString&, int, int))); } Mussa::Mussa(const Mussa& m) @@ -53,8 +51,14 @@ Mussa::Mussa(const Mussa& m) analysis_path(m.analysis_path), dirty(m.dirty) { - connect(&the_paths, SIGNAL(progress(const std::string&, int, int)), - this, SIGNAL(progress(const std::string&, int, int))); + connect(&the_paths, SIGNAL(progress(const QString&, int, int)), + this, SIGNAL(progress(const QString&, int, int))); +} + +MussaRef Mussa::init() +{ + boost::shared_ptr m(new Mussa()); + return m; } boost::filesystem::path Mussa::get_analysis_path() const @@ -62,6 +66,11 @@ boost::filesystem::path Mussa::get_analysis_path() const return analysis_path; } +void Mussa::set_analysis_path(boost::filesystem::path pathname) +{ + analysis_path = pathname; +} + // set all parameters to null state void Mussa::clear() @@ -78,7 +87,15 @@ Mussa::clear() the_seqs.clear(); the_paths.clear(); analysis_path = fs::path(); - dirty = false; + set_dirty(false); +} + +void Mussa::set_dirty(bool new_state) +{ + if (dirty != new_state) { + dirty = new_state; + emit isModified(dirty); + } } bool Mussa::is_dirty() const @@ -99,14 +116,26 @@ void Mussa::set_name(string a_name) { analysis_name = a_name; - dirty = true; + set_dirty(true); } -string Mussa::get_name() +string Mussa::get_name() const { return analysis_name; } +string Mussa::get_title() const +{ + fs::path analysis_path = get_analysis_path(); + if (not analysis_path.empty()) { + return analysis_path.native_file_string(); + } else if (get_name().size() > 0) { + return get_name(); + } else { + return std::string("Unnamed"); + } +} + int Mussa::size() const { @@ -120,7 +149,7 @@ void Mussa::set_window(int a_window) { window = a_window; - dirty = true; + set_dirty(true); } int Mussa::get_window() const @@ -132,7 +161,7 @@ void Mussa::set_threshold(int a_threshold) { threshold = a_threshold; - dirty = true; + set_dirty(true); if (a_threshold > soft_thres) { soft_thres = a_threshold; } @@ -164,7 +193,7 @@ void Mussa::set_analysis_mode(enum analysis_modes new_ana_mode) { ana_mode = new_ana_mode; - dirty = true; + set_dirty(true); } enum Mussa::analysis_modes Mussa::get_analysis_mode() const @@ -291,17 +320,17 @@ void Mussa::append_sequence(const Sequence& a_seq) { boost::shared_ptr seq_copy(new Sequence(a_seq)); the_seqs.push_back(seq_copy); - dirty = true; + set_dirty(true); } void Mussa::append_sequence(boost::shared_ptr a_seq) { the_seqs.push_back(a_seq); - dirty = true; + set_dirty(true); } -const vector >& +const vector& Mussa::sequences() const { return the_seqs; @@ -320,13 +349,38 @@ void Mussa::load_sequence(fs::path seq_file, fs::path annot_file, aseq->set_species(*name); } the_seqs.push_back(aseq); - dirty = true; + set_dirty(true); +} + +void Mussa::load_mupa_file(std::string para_file_path) { + load_mupa_file(boost::filesystem::path(para_file_path)); } void Mussa::load_mupa_file(fs::path para_file_path) { - fs::ifstream para_file; + if (not fs::exists(para_file_path)) + { + throw mussa_load_error("Config File: " + para_file_path.string() + " not found"); + } else if (fs::is_directory(para_file_path)) { + throw mussa_load_error("Config File: " + para_file_path.string() + " is a directory."); + } else if (fs::is_empty(para_file_path)) { + throw mussa_load_error("Config File: " + para_file_path.string() + " is empty"); + } else { + // what directory is the mupa file in? + fs::path file_path_base( para_file_path.branch_path()) ; + + fs::ifstream para_file; + para_file.open(para_file_path, ios::in); + + load_mupa_stream(para_file, file_path_base); + para_file.close(); + } +} + +void +Mussa::load_mupa_stream(std::istream& para_file, fs::path& file_path_base) +{ string file_data_line; string param, value; fs::path annot_file; @@ -340,103 +394,86 @@ Mussa::load_mupa_file(fs::path para_file_path) // initialize values clear(); - // if file was opened, read the parameter values - if (not fs::exists(para_file_path)) + // setup loop by getting file's first line + getline(para_file, file_data_line); + split_index = file_data_line.find(" "); + param = file_data_line.substr(0,split_index); + value = file_data_line.substr(split_index+1); + + while (para_file) { - throw mussa_load_error("Config File: " + para_file_path.string() + " not found"); - } else if (fs::is_directory(para_file_path)) { - throw mussa_load_error("Config File: " + para_file_path.string() + " is a directory."); - } else if (fs::is_empty(para_file_path)) { - throw mussa_load_error("Config File: " + para_file_path.string() + " is empty"); - } else { - para_file.open(para_file_path, ios::in); - - // what directory is the mupa file in? - fs::path file_path_base = para_file_path.branch_path(); - - // setup loop by getting file's first line - getline(para_file,file_data_line); - split_index = file_data_line.find(" "); - param = file_data_line.substr(0,split_index); - value = file_data_line.substr(split_index+1); - - while (para_file) + did_seq = false; + if (param == "ANA_NAME") + analysis_name = value; + else if (param == "APPEND_WIN") + win_append = true; + else if (param == "APPEND_THRES") + thres_append = true; + else if (param == "SEQUENCE_NUM") + ; // ignore sequence_num now + else if (param == "WINDOW") + window = atoi(value.c_str()); + else if (param == "THRESHOLD") + threshold = atoi(value.c_str()); + else if (param == "SEQUENCE") { - did_seq = false; - if (param == "ANA_NAME") - analysis_name = value; - else if (param == "APPEND_WIN") - win_append = true; - else if (param == "APPEND_THRES") - thres_append = true; - else if (param == "SEQUENCE_NUM") - ; // ignore sequence_num now - else if (param == "WINDOW") - window = atoi(value.c_str()); - else if (param == "THRESHOLD") - threshold = atoi(value.c_str()); - else if (param == "SEQUENCE") - { - fs::path seq_file = file_path_base / value; - //cout << "seq_file_name " << seq_files.back() << endl; - fasta_index = 1; - annot_file = ""; - sub_seq_start = 0; - sub_seq_end = 0; - seq_params = true; - - while (para_file && seq_params) - { - getline(para_file,file_data_line); - split_index = file_data_line.find(" "); - param = file_data_line.substr(0,split_index); - value = file_data_line.substr(split_index+1); - - if (param == "FASTA_INDEX") - fasta_index = atoi(value.c_str()); - else if (param == "ANNOTATION") - annot_file = file_path_base / value; - else if (param == "SEQ_START") - sub_seq_start = atoi(value.c_str()); - else if (param == "SEQ_END") - { - sub_seq_end = atoi(value.c_str()); - } - //ignore empty lines or that start with '#' - else if ((param == "") || (param == "#")) {} - else seq_params = false; - } - load_sequence(seq_file, annot_file, fasta_index, sub_seq_start, - sub_seq_end); - did_seq = true; - } - //ignore empty lines or that start with '#' - else if ((param == "") || (param == "#")) {} - else - { - clog << "Illegal/misplaced mussa parameter in file\n"; - clog << param << "\n"; - } - - if (!did_seq) + fs::path seq_file = file_path_base / value; + //cout << "seq_file_name " << seq_files.back() << endl; + fasta_index = 1; + annot_file = ""; + sub_seq_start = 0; + sub_seq_end = 0; + seq_params = true; + + while (para_file && seq_params) { - getline(para_file,file_data_line); + multiplatform_getline(para_file,file_data_line); split_index = file_data_line.find(" "); param = file_data_line.substr(0,split_index); value = file_data_line.substr(split_index+1); - did_seq = false; + + if (param == "FASTA_INDEX") + fasta_index = atoi(value.c_str()); + else if (param == "ANNOTATION") + annot_file = file_path_base / value; + else if (param == "SEQ_START") + sub_seq_start = atoi(value.c_str()); + else if (param == "SEQ_END") + { + sub_seq_end = atoi(value.c_str()); + } + //ignore empty lines or that start with '#' + else if ((param == "") || (param == "#")) { + // pass + } else { + seq_params = false; + } } + load_sequence(seq_file, annot_file, fasta_index, sub_seq_start, + sub_seq_end); + did_seq = true; + } + //ignore empty lines or that start with '#' + else if ((param == "") || (param == "#")) {} + else + { + clog << "Illegal/misplaced mussa parameter in file\n"; + clog << param << "\n"; } - para_file.close(); - - soft_thres = threshold; - //cout << "nway mupa: analysis_name = " << analysis_name - // << " window = " << window - // << " threshold = " << threshold << endl; + if (!did_seq) + { + multiplatform_getline(para_file,file_data_line); + split_index = file_data_line.find(" "); + param = file_data_line.substr(0,split_index); + value = file_data_line.substr(split_index+1); + did_seq = false; + } } + + soft_thres = threshold; // no file was loaded, signal error - dirty = true; + set_dirty(true); } @@ -447,8 +484,7 @@ Mussa::analyze() throw mussa_analysis_error("you need to have at least 2 sequences to " "do an analysis."); } - //cout << "nway ana: seq_num = " << the_seqs.size() << endl; - + seqcomp(); the_paths.setup(window, threshold); nway(); @@ -524,13 +560,14 @@ Mussa::nway() void Mussa::save(fs::path save_path) { - fs::path flp_filepath; fs::fstream save_file; ostringstream append_info; int dir_create_status; if (save_path.empty()) { - if (not analysis_name.empty()) { + if (not analysis_path.empty()) { + save_path = analysis_path; + } else if (not analysis_name.empty()) { std::string save_name = analysis_name; // gotta do bit with adding win & thres if to be appended if (win_append) { @@ -553,8 +590,12 @@ Mussa::save(fs::path save_path) if (not fs::exists(save_path)) { fs::create_directory(save_path); } + + std::string basename = save_path.leaf(); + fs::path museq(basename + ".museq", fs::native); + // save sequence and annots to a special mussa file - save_file.open(save_path / (save_path.leaf()+".museq"), ios::out); + save_file.open(save_path / museq, ios::out); save_file << "" << endl; for(vector::size_type i = 0; i < the_seqs.size(); i++) @@ -565,18 +606,27 @@ Mussa::save(fs::path save_path) save_file << "" << endl; save_file.close(); + // if we have any motifs, save them. + if (motif_sequences.size()) { + fs::path mtl(basename + ".mtl", fs::native); + save_motifs(save_path / mtl); + } + // save nway paths to its mussa save file - the_paths.save(save_path / (save_path.leaf()+ ".muway")); + fs::path muway(basename + ".muway", fs::native); + the_paths.save(save_path / muway); for(vector::size_type i = 0; i < the_seqs.size(); i++) { for(vector::size_type i2 = i+1; i2 < the_seqs.size(); i2++) { append_info.str(""); append_info << "_sp_" << i << "v" << i2; - all_comps[i][i2].save(save_path/(save_path.leaf()+append_info.str()+".flp")); + fs::path flp(basename+append_info.str()+".flp", fs::native); + all_comps[i][i2].save(save_path / flp); } } - dirty = false; + + set_dirty(false); analysis_path = save_path; } @@ -599,13 +649,14 @@ Mussa::load(fs::path ana_file) vector empty_FLP_vector; FLPs dummy_comp; + + //-------------------------------------------------------- + // Load Muway + //-------------------------------------------------------- analysis_path = ana_file; - //clog << "ana_file name " << ana_file.string() << endl; analysis_name = ana_path.leaf(); - //clog << " ana_name " << analysis_name << endl; - file_path_base = ana_path.branch_path() / analysis_name; - a_file_path = file_path_base / (analysis_name + ".muway"); - //clog << " loading museq: " << a_file_path.string() << endl; + fs::path muway(analysis_name+".muway", fs::native); + a_file_path = analysis_path / muway; the_paths.load(a_file_path); // perhaps this could be more elegent, but at least this'll let // us know what our threshold and window sizes were when we load a muway @@ -613,19 +664,63 @@ Mussa::load(fs::path ana_file) threshold = the_paths.get_threshold(); soft_thres = threshold; - int seq_num = the_paths.sequence_count(); - a_file_path = file_path_base / (analysis_name + ".museq"); + //-------------------------------------------------------- + // Load Sequence + //-------------------------------------------------------- + //int seq_num = the_paths.sequence_count(); + + fs::path museq(analysis_name + ".museq", fs::native); + a_file_path = analysis_path / museq; // this is a bit of a hack due to C++ not acting like it should with files - for (i = 1; i <= seq_num; i++) + /*for (i = 1; i <= seq_num; i++) { boost::shared_ptr tmp_seq(new Sequence); - //clog << "mussa_class: loading museq frag... " << a_file_path.string() << endl; tmp_seq->load_museq(a_file_path, i); the_seqs.push_back(tmp_seq); + }*/ + + i = 1; + //int seq_num = 0; + boost::filesystem::fstream load_museq_fs; + load_museq_fs.open(a_file_path, std::ios::in); + boost::shared_ptr tmp_seq; + while (1) + { + tmp_seq = Sequence::load_museq(load_museq_fs); + + if (tmp_seq) + { + the_seqs.push_back(tmp_seq); + } + else + { + break; + } + + + //safe guard in case of an infinate loop. + //FIXME: If mussa can handle a comparison of 10000 sequences + // in the future, then this code should be fixed. + if (i == 10000) + { + throw mussa_load_error(" Run away sequence load!"); + } + i++; + } + load_museq_fs.close(); + + //-------------------------------------------------------- + // Load Motifs + //-------------------------------------------------------- + fs::path mtl(analysis_name + ".mtl", fs::native); + fs::path motif_file = analysis_path / mtl; + if (fs::exists(motif_file)) { + load_motifs(motif_file); } + vector::size_type seq_num = the_seqs.size(); empty_FLP_vector.clear(); for(i = 0; i < seq_num; i++) { @@ -634,6 +729,7 @@ Mussa::load(fs::path ana_file) all_comps[i].push_back(dummy_comp); } + for(i = 0; i < seq_num; i++) { for(i2 = i+1; i2 < seq_num; i2++) @@ -641,15 +737,13 @@ Mussa::load(fs::path ana_file) append_info.str(""); append_info << analysis_name << "_sp_" << i << "v" << i2 << ".flp"; //clog << append_info.str() << endl; - a_file_path = file_path_base / append_info.str(); - //clog << "path " << a_file_path.string() << endl; + fs::path flp(append_info.str(), fs::native); + a_file_path = analysis_path / flp; all_comps[i][i2].load(a_file_path); - //clog << "real size = " << all_comps[i][i2].size() << endl; } } } - void Mussa::save_old() { @@ -726,6 +820,7 @@ void Mussa::add_motif(const Sequence& motif, const Color& color) { motif_sequences.insert(motif); color_mapper->appendInstanceColor("motif", motif.get_sequence(), color); + set_dirty(true); } void Mussa::set_motifs(const vector& motifs, @@ -743,60 +838,18 @@ void Mussa::set_motifs(const vector& motifs, update_sequences_motifs(); } - -// Helper functor to append created motifs to our Mussa analysis -struct push_back_motif { - std::set& motif_set; - boost::shared_ptr color_mapper; - std::string& seq_string; - std::string& name; - float& red; - float& green; - float& blue; - - push_back_motif(std::set& motif_set_, - boost::shared_ptr color_mapper_, - std::string& seq_, - std::string& name_, - float red_, float green_, float blue_) - : motif_set(motif_set_), - color_mapper(color_mapper_), - seq_string(seq_), - name(name_), - red(red_), - green(green_), - blue(blue_) - { - } - - void operator()(std::string::const_iterator, - std::string::const_iterator) const - { - //std::cout << "motif: " << seq_string << "/" << name << endl; - - Sequence seq(seq_string); - // shouldn't we have a better field than "fasta header" and speices? - seq.set_fasta_header(name); - // we need to clear the name in case the next motif doesn't have one. - name.clear(); - // be nice if glsequence was a subclass of sequence so we could - // just attach colors directly to the motif. - Color c(red, green, blue); - color_mapper->appendInstanceColor("motif", seq.c_str(), c); - motif_set.insert(seq); - }; -}; - -// I mostly split the ifstream out so I can use a stringstream to test it. +void Mussa::load_motifs(fs::path filename) +{ + fs::ifstream f; + f.open(filename, ifstream::in); + load_motifs(f); +} + void Mussa::load_motifs(std::istream &in) { std::string data; - const char *alphabet = Sequence::nucleic_iupac_alphabet.c_str(); - string seq; - string name; - float red; - float green; - float blue; + const char *alphabet = Alphabet::dna_cstr; + motif_parser::ParsedMotifs parsed_motifs(motif_sequences, color_mapper); // slurp our data into a string std::streamsize bytes_read = 1; @@ -806,38 +859,37 @@ void Mussa::load_motifs(std::istream &in) bytes_read = in.readsome(buf, bufsiz); data.append(buf, buf+bytes_read); } - // parse our string - bool status = spirit::parse(data.begin(), data.end(), - *( - ( - ( - (+spirit::chset<>(alphabet))[spirit::assign_a(seq)] >> - +spirit::space_p - ) >> - !( - (spirit::alpha_p >> *spirit::alnum_p)[spirit::assign_a(name)] - >> +spirit::space_p - ) >> - spirit::real_p[spirit::assign_a(red)] >> +spirit::space_p >> - spirit::real_p[spirit::assign_a(green)] >> +spirit::space_p >> - spirit::real_p[spirit::assign_a(blue)] >> +spirit::space_p - )[push_back_motif(motif_sequences, color_mapper, seq, name, red, green, blue)] - )).full; + parsed_motifs.parse(data); update_sequences_motifs(); } -void Mussa::load_motifs(fs::path filename) +void Mussa::save_motifs(fs::path filename) { - fs::ifstream f; - f.open(filename, ifstream::in); - load_motifs(f); + fs::ofstream out_stream; + out_stream.open(filename, ofstream::out); + save_motifs(out_stream); +} + +void Mussa::save_motifs(std::ostream& out) +{ + for(motif_set::iterator motif_i = motif_sequences.begin(); + motif_i != motif_sequences.end(); + ++motif_i) + { + out << motif_i->get_sequence() << " "; + if (motif_i->get_name().size() > 0) { + out << "\"" << motif_i->get_name() << "\" "; + } + out << color_mapper->lookup("motif", motif_i->get_sequence()); + out << std::endl; + } } void Mussa::update_sequences_motifs() { // once we've loaded all the motifs from the file, // lets attach them to the sequences - for(vector >::iterator seq_i = the_seqs.begin(); + for(vector::iterator seq_i = the_seqs.begin(); seq_i != the_seqs.end(); ++seq_i) {