1 | // =============================================================== // |
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2 | // // |
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3 | // File : PT_match.cxx // |
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4 | // Purpose : // |
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5 | // // |
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6 | // Institute of Microbiology (Technical University Munich) // |
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7 | // http://www.arb-home.de/ // |
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8 | // // |
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9 | // =============================================================== // |
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10 | |
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11 | #include "probe.h" |
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12 | #include <PT_server_prototypes.h> |
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13 | #include <struct_man.h> |
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14 | |
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15 | #include "pt_split.h" |
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16 | #include "probe_tree.h" |
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17 | |
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18 | #include <arb_strbuf.h> |
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19 | #include <arb_defs.h> |
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20 | #include <arb_sort.h> |
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21 | #include <cctype> |
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22 | #include <map> |
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23 | |
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24 | // overloaded functions to avoid problems with type-punning: |
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25 | inline void aisc_link(dll_public *dll, PT_probematch *match) { aisc_link(reinterpret_cast<dllpublic_ext*>(dll), reinterpret_cast<dllheader_ext*>(match)); } |
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26 | |
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27 | class MatchRequest; |
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28 | class Mismatches { |
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29 | MatchRequest& req; |
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30 | |
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31 | int plain; // plain mismatch between 2 standard bases |
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32 | int ambig; // mismatch with N or '.' involved |
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33 | |
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34 | double weighted; // weighted mismatches |
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35 | |
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36 | public: |
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37 | |
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38 | Mismatches(MatchRequest& req_) : req(req_), plain(0), ambig(0), weighted(0.0) {} |
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39 | |
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40 | inline void count_weighted(char probe, char seq, int height); |
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41 | void count_versus(const ReadableDataLoc& loc, const char *probe, int height); |
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42 | |
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43 | inline bool accepted() const; |
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44 | |
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45 | int get_plain() const { return plain; } |
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46 | int get_ambig() const { return ambig; } |
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47 | |
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48 | double get_weighted() const { return weighted; } |
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49 | |
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50 | inline PT_local& get_PT_local() const; |
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51 | }; |
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52 | |
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53 | class MatchRequest : virtual Noncopyable { |
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54 | PT_local& pt_local; |
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55 | |
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56 | int max_ambig; // max. possible ambiguous hits (i.e. max value in Mismatches::ambig) |
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57 | int *accepted_N_mismatches; |
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58 | |
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59 | MismatchWeights weights; |
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60 | |
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61 | void init_accepted_N_mismatches(int ignored_Nmismatches, int when_less_than_Nmismatches); |
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62 | |
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63 | public: |
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64 | explicit MatchRequest(PT_local& locs, int probe_length) |
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65 | : pt_local(locs), |
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66 | max_ambig(probe_length), |
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67 | accepted_N_mismatches(new int[max_ambig+1]), |
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68 | weights(locs.bond) |
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69 | { |
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70 | init_accepted_N_mismatches(pt_local.pm_nmatches_ignored, pt_local.pm_nmatches_limit); |
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71 | } |
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72 | ~MatchRequest() { |
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73 | delete [] accepted_N_mismatches; |
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74 | } |
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75 | |
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76 | PT_local& get_PT_local() const { return pt_local; } |
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77 | |
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78 | bool hit_limit_reached() const { |
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79 | bool reached = pt_local.pm_max_hits>0 && pt_local.ppm.cnt >= pt_local.pm_max_hits; |
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80 | if (reached) pt_local.matches_truncated = 1; |
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81 | return reached; |
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82 | } |
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83 | |
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84 | int accept_N_mismatches(int ambig) const { |
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85 | pt_assert(ambig<=max_ambig); |
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86 | return accepted_N_mismatches[ambig]; |
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87 | } |
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88 | |
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89 | bool add_hit(const DataLoc& at, const Mismatches& mismatch); |
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90 | bool add_hits_for_children(POS_TREE2 *pt, const Mismatches& mismatch); |
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91 | bool collect_hits_for(const char *probe, POS_TREE2 *pt, Mismatches& mismatch, int height); |
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92 | |
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93 | int allowed_mismatches() const { return pt_local.pm_max; } |
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94 | double get_mismatch_weight(char probe, char seq) const { return weights.get(probe, seq); } |
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95 | }; |
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96 | |
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97 | |
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98 | |
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99 | void MatchRequest::init_accepted_N_mismatches(int ignored_Nmismatches, int when_less_than_Nmismatches) { |
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100 | // calculate table for PT_N mismatches |
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101 | // |
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102 | // 'ignored_Nmismatches' specifies, how many N-mismatches will be accepted as |
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103 | // matches, when overall number of N-mismatches is below 'when_less_than_Nmismatches'. |
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104 | // |
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105 | // above that limit, every N-mismatch counts as mismatch |
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106 | |
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107 | when_less_than_Nmismatches = std::min(when_less_than_Nmismatches, max_ambig+1); |
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108 | ignored_Nmismatches = std::min(ignored_Nmismatches, when_less_than_Nmismatches-1); |
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109 | |
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110 | accepted_N_mismatches[0] = 0; |
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111 | int mm; |
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112 | for (mm = 1; mm<when_less_than_Nmismatches; ++mm) { // LOOP_VECTORIZED=* (1 loop prior; 2 loops reported with 7.x) |
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113 | accepted_N_mismatches[mm] = mm>ignored_Nmismatches ? mm-ignored_Nmismatches : 0; |
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114 | } |
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115 | pt_assert(mm <= (max_ambig+1)); |
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116 | for (; mm <= max_ambig; ++mm) { |
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117 | accepted_N_mismatches[mm] = mm; |
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118 | } |
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119 | } |
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120 | |
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121 | inline void Mismatches::count_weighted(char probe, char seq, int height) { |
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122 | bool is_ambig = is_ambig_base(probe) || is_ambig_base(seq); |
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123 | if (is_ambig || probe != seq) { |
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124 | if (is_ambig) ambig++; else plain++; |
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125 | weighted += req.get_mismatch_weight(probe, seq) * psg.pos_to_weight[height]; |
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126 | } |
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127 | } |
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128 | |
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129 | inline bool Mismatches::accepted() const { |
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130 | if (get_PT_local().sort_by == PT_MATCH_TYPE_INTEGER) { |
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131 | return (req.accept_N_mismatches(ambig)+plain) <= req.allowed_mismatches(); |
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132 | } |
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133 | return weighted <= (req.allowed_mismatches()+0.5); |
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134 | } |
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135 | |
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136 | inline PT_local& Mismatches::get_PT_local() const { |
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137 | return req.get_PT_local(); |
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138 | } |
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139 | |
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140 | bool MatchRequest::add_hit(const DataLoc& at, const Mismatches& mismatch) { |
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141 | PT_probematch *ml = create_PT_probematch(); |
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142 | |
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143 | ml->name = at.get_name(); |
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144 | ml->b_pos = at.get_abs_pos(); |
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145 | ml->g_pos = -1; |
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146 | ml->rpos = at.get_rel_pos(); |
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147 | |
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148 | ml->mismatches = mismatch.get_plain() + accept_N_mismatches(mismatch.get_ambig()); |
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149 | ml->wmismatches = mismatch.get_weighted(); |
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150 | ml->N_mismatches = mismatch.get_ambig(); |
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151 | |
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152 | ml->sequence = psg.main_probe; |
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153 | ml->reversed = psg.reversed ? 1 : 0; |
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154 | |
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155 | aisc_link(&get_PT_local().ppm, ml); |
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156 | |
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157 | return hit_limit_reached(); |
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158 | } |
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159 | |
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160 | bool MatchRequest::add_hits_for_children(POS_TREE2 *pt, const Mismatches& mismatch) { |
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161 | //! go down the tree to chains and leafs; copy names, positions and mismatches in locs structure |
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162 | |
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163 | pt_assert(pt && mismatch.accepted()); // invalid or superfluous call |
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164 | pt_assert(!hit_limit_reached()); |
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165 | |
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166 | bool enough = false; |
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167 | switch (pt->get_type()) { |
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168 | case PT2_LEAF: |
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169 | enough = add_hit(DataLoc(pt), mismatch); |
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170 | break; |
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171 | |
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172 | case PT2_CHAIN: { |
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173 | ChainIteratorStage2 entry(pt); |
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174 | while (entry && !enough) { |
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175 | enough = add_hit(DataLoc(entry.at()), mismatch); |
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176 | ++entry; |
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177 | } |
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178 | break; |
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179 | } |
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180 | case PT2_NODE: |
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181 | for (int base = PT_QU; base < PT_BASES && !enough; base++) { |
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182 | POS_TREE2 *son = PT_read_son(pt, (PT_base)base); |
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183 | if (son) enough = add_hits_for_children(son, mismatch); |
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184 | } |
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185 | break; |
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186 | } |
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187 | return enough; |
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188 | } |
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189 | |
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190 | void Mismatches::count_versus(const ReadableDataLoc& loc, const char *probe, int height) { |
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191 | int base; |
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192 | while ((base = probe[height])) { |
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193 | int ref = loc[height]; |
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194 | if (ref == PT_QU) break; |
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195 | |
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196 | count_weighted(base, ref, height); |
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197 | height++; |
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198 | } |
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199 | |
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200 | if (base != PT_QU) { // not end of probe |
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201 | pt_assert(loc[height] == PT_QU); // at EOS |
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202 | do { |
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203 | count_weighted(base, PT_QU, height); |
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204 | height++; |
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205 | } |
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206 | while ((base = probe[height])); |
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207 | } |
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208 | } |
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209 | |
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210 | bool MatchRequest::collect_hits_for(const char *probe, POS_TREE2 *pt, Mismatches& mismatches, const int height) { |
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211 | //! search down the tree to find matching species for the given probe |
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212 | |
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213 | pt_assert(pt && mismatches.accepted()); // invalid or superfluous call |
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214 | pt_assert(!hit_limit_reached()); |
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215 | |
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216 | bool enough = false; |
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217 | if (probe[height] == PT_QU) { |
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218 | enough = add_hits_for_children(pt, mismatches); |
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219 | } |
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220 | else { |
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221 | switch (pt->get_type()) { |
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222 | case PT2_LEAF: { |
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223 | ReadableDataLoc loc(pt); |
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224 | mismatches.count_versus(loc, probe, height); |
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225 | if (mismatches.accepted()) { |
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226 | enough = add_hit(loc, mismatches); |
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227 | } |
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228 | break; |
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229 | } |
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230 | case PT2_CHAIN: { |
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231 | pt_assert(probe); |
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232 | |
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233 | ChainIteratorStage2 entry(pt); |
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234 | while (entry && !enough) { |
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235 | Mismatches entry_mismatches(mismatches); |
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236 | DataLoc dloc(entry.at()); // @@@ EXPENSIVE_CONVERSION |
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237 | entry_mismatches.count_versus(ReadableDataLoc(dloc), probe, height); // @@@ EXPENSIVE_CONVERSION |
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238 | if (entry_mismatches.accepted()) { |
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239 | enough = add_hit(dloc, entry_mismatches); |
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240 | } |
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241 | ++entry; |
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242 | } |
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243 | break; |
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244 | } |
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245 | case PT2_NODE: |
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246 | for (int i=PT_QU; i<PT_BASES && !enough; i++) { |
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247 | POS_TREE2 *son = PT_read_son(pt, (PT_base)i); |
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248 | if (son) { |
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249 | Mismatches son_mismatches(mismatches); |
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250 | son_mismatches.count_weighted(probe[height], i, height); |
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251 | if (son_mismatches.accepted()) { |
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252 | if (i == PT_QU) { |
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253 | // @@@ calculation here is constant for a fixed probe (cache results) |
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254 | pt_assert(probe[height] != PT_QU); |
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255 | |
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256 | int son_height = height+1; |
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257 | while (1) { |
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258 | int base = probe[son_height]; |
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259 | if (base == PT_QU) { |
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260 | if (son_mismatches.accepted()) { |
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261 | enough = add_hits_for_children(son, son_mismatches); |
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262 | } |
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263 | break; |
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264 | } |
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265 | |
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266 | son_mismatches.count_weighted(base, PT_QU, son_height); |
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267 | if (!son_mismatches.accepted()) break; |
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268 | |
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269 | ++son_height; |
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270 | } |
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271 | } |
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272 | else { |
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273 | enough = collect_hits_for(probe, son, son_mismatches, height+1); |
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274 | } |
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275 | } |
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276 | } |
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277 | } |
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278 | break; |
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279 | } |
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280 | } |
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281 | |
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282 | return enough; |
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283 | } |
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284 | |
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285 | static int pt_sort_compare_match(const void *PT_probematch_ptr1, const void *PT_probematch_ptr2, void *) { |
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286 | const PT_probematch *mach1 = (const PT_probematch*)PT_probematch_ptr1; |
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287 | const PT_probematch *mach2 = (const PT_probematch*)PT_probematch_ptr2; |
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288 | |
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289 | if (psg.sort_by != PT_MATCH_TYPE_INTEGER) { |
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290 | if (mach1->wmismatches > mach2->wmismatches) return 1; |
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291 | if (mach1->wmismatches < mach2->wmismatches) return -1; |
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292 | } |
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293 | |
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294 | int cmp = mach1->mismatches - mach2->mismatches; |
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295 | if (!cmp) { |
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296 | cmp = mach1->N_mismatches - mach2->N_mismatches; |
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297 | if (!cmp) { |
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298 | if (mach1->wmismatches < mach2->wmismatches) cmp = -1; |
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299 | else if (mach1->wmismatches > mach2->wmismatches) cmp = 1; |
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300 | else { |
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301 | cmp = mach1->b_pos - mach2->b_pos; |
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302 | if (!cmp) { |
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303 | cmp = mach1->name - mach2->name; |
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304 | } |
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305 | } |
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306 | } |
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307 | } |
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308 | |
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309 | return cmp; |
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310 | } |
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311 | |
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312 | static void pt_sort_match_list(PT_local * locs) { |
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313 | if (locs->pm) { |
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314 | psg.sort_by = locs->sort_by; |
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315 | |
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316 | int list_len = locs->pm->get_count(); |
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317 | if (list_len > 1) { |
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318 | PT_probematch **my_list; ARB_calloc(my_list, list_len); |
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319 | { |
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320 | PT_probematch *match = locs->pm; |
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321 | for (int i=0; match; i++) { |
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322 | my_list[i] = match; |
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323 | match = match->next; |
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324 | } |
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325 | } |
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326 | GB_sort((void **)my_list, 0, list_len, pt_sort_compare_match, NULp); |
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327 | for (int i=0; i<list_len; i++) { |
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328 | aisc_unlink((dllheader_ext*)my_list[i]); |
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329 | aisc_link(&locs->ppm, my_list[i]); |
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330 | } |
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331 | free(my_list); |
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332 | } |
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333 | } |
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334 | } |
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335 | char *create_reversed_probe(char *probe, int len) { |
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336 | //! reverse order of bases in a probe |
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337 | char *rev_probe = ARB_strduplen(probe, len); |
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338 | reverse_probe(rev_probe, len); |
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339 | return rev_probe; |
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340 | } |
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341 | |
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342 | CONSTEXPR_INLINE double calc_position_wmis(int pos, int seq_len, double y1, double y2) { |
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343 | return (double)(((double)(pos * (seq_len - 1 - pos)) / (double)((seq_len - 1) * (seq_len - 1)))* (double)(y2*4.0) + y1); |
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344 | } |
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345 | |
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346 | static void pt_build_pos_to_weight(PT_MATCH_TYPE type, const char *sequence) { |
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347 | delete [] psg.pos_to_weight; |
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348 | int slen = strlen(sequence); |
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349 | psg.pos_to_weight = new double[slen+1]; |
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350 | int p; |
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351 | for (p=0; p<slen; p++) { // LOOP_VECTORIZED=* (no idea why this is instantiated 4 times for gcc<8.1. inline would/does cause 2 instantiations, as encountered with gcc 8.1) |
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352 | if (type == PT_MATCH_TYPE_WEIGHTED_PLUS_POS) { |
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353 | psg.pos_to_weight[p] = calc_position_wmis(p, slen, 0.3, 1.0); |
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354 | } |
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355 | else { |
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356 | psg.pos_to_weight[p] = 1.0; |
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357 | } |
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358 | } |
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359 | psg.pos_to_weight[slen] = 0; |
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360 | } |
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361 | |
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362 | static std::map<PT_local*,Splits> splits_for_match_overlay; // initialized by probe-match, used by match-retrieval (one entry for each match-request); @@@ leaks.. 1 entry for each request |
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363 | |
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364 | int probe_match(PT_local *locs, aisc_string probestring) { |
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365 | //! find out where a given probe matches |
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366 | |
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367 | freedup(locs->pm_sequence, probestring); |
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368 | psg.main_probe = locs->pm_sequence; |
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369 | |
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370 | compress_data(probestring); |
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371 | while (PT_probematch *ml = locs->pm) destroy_PT_probematch(ml); |
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372 | locs->matches_truncated = 0; |
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373 | |
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374 | #if defined(DEBUG) && 0 |
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375 | printf("Current bond values:\n"); |
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376 | for (int y = 0; y<4; y++) { |
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377 | for (int x = 0; x<4; x++) { |
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378 | printf("%5.2f", locs->bond[y*4+x].val); |
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379 | } |
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380 | printf("\n"); |
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381 | } |
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382 | #endif // DEBUG |
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383 | |
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384 | int probe_len = strlen(probestring); |
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385 | bool failed = false; |
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386 | if (probe_len<MIN_PROBE_LENGTH) { |
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387 | pt_export_error(locs, GBS_global_string("Min. probe length is %i", MIN_PROBE_LENGTH)); |
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388 | failed = true; |
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389 | } |
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390 | else { |
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391 | int max_poss_mismatches = probe_len/2; |
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392 | pt_assert(max_poss_mismatches>0); |
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393 | if (locs->pm_max > max_poss_mismatches) { |
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394 | pt_export_error(locs, GBS_global_string("Max. %i mismatch%s are allowed for probes of length %i", |
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395 | max_poss_mismatches, |
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396 | max_poss_mismatches == 1 ? "" : "es", |
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397 | probe_len)); |
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398 | failed = true; |
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399 | } |
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400 | } |
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401 | |
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402 | if (!failed) { |
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403 | if (locs->pm_complement_first) { |
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404 | complement_probe(probestring, probe_len); |
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405 | } |
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406 | psg.reversed = 0; |
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407 | |
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408 | freedup(locs->pm_sequence, probestring); |
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409 | psg.main_probe = locs->pm_sequence; |
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410 | |
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411 | pt_build_pos_to_weight((PT_MATCH_TYPE)locs->sort_by, probestring); |
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412 | |
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413 | MatchRequest req(*locs, probe_len); |
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414 | |
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415 | pt_assert(req.allowed_mismatches() >= 0); // till [8011] value<0 was used to trigger "new match" (feature unused) |
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416 | Mismatches mismatch(req); |
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417 | req.collect_hits_for(probestring, psg.TREE_ROOT2(), mismatch, 0); |
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418 | |
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419 | if (locs->pm_also_revcomp) { |
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420 | psg.reversed = 1; |
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421 | char *rev_pro = create_reversed_probe(probestring, probe_len); |
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422 | complement_probe(rev_pro, probe_len); |
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423 | freeset(locs->pm_csequence, psg.main_probe = ARB_strdup(rev_pro)); |
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424 | |
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425 | Mismatches rev_mismatch(req); |
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426 | req.collect_hits_for(rev_pro, psg.TREE_ROOT2(), rev_mismatch, 0); |
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427 | free(rev_pro); |
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428 | } |
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429 | pt_sort_match_list(locs); |
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430 | splits_for_match_overlay[locs] = Splits(locs); |
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431 | } |
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432 | free(probestring); |
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433 | |
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434 | return 0; |
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435 | } |
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436 | |
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437 | struct format_props { |
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438 | bool show_mismatches; // whether to show 'mis' and 'N_mis' |
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439 | bool show_ecoli; // whether to show 'ecoli' column |
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440 | bool show_gpos; // whether to show 'gpos' column |
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441 | |
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442 | int name_width; // width of 'name' column |
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443 | int gene_or_full_width; // width of 'genename' or 'fullname' column |
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444 | int pos_width; // max. width of pos column |
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445 | int gpos_width; // max. width of gpos column |
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446 | int ecoli_width; // max. width of ecoli column |
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447 | |
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448 | int rev_width() const { return 3; } |
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449 | int mis_width() const { return 3; } |
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450 | int N_mis_width() const { return 5; } |
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451 | int wmis_width() const { return 4; } |
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452 | }; |
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453 | |
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454 | inline void set_max(const char *str, int &curr_max) { |
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455 | if (str) { |
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456 | int len = strlen(str); |
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457 | if (len>curr_max) curr_max = len; |
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458 | } |
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459 | } |
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460 | |
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461 | static format_props detect_format_props(const PT_local *locs, bool show_gpos) { |
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462 | PT_probematch *ml = locs->pm; // probe matches |
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463 | format_props format; |
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464 | |
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465 | format.show_mismatches = (ml->N_mismatches >= 0); |
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466 | format.show_ecoli = psg.ecoli; // display only if there is ecoli |
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467 | format.show_gpos = show_gpos; // display only for gene probe matches |
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468 | |
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469 | // minimum values (caused by header widths) : |
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470 | format.name_width = gene_flag ? 8 : 4; // 'organism' or 'name' |
---|
471 | format.gene_or_full_width = 8; // 'genename' or 'fullname' |
---|
472 | format.pos_width = 3; // 'pos' |
---|
473 | format.gpos_width = 4; // 'gpos' |
---|
474 | format.ecoli_width = 5; // 'ecoli' |
---|
475 | |
---|
476 | for (; ml; ml = ml->next) { |
---|
477 | set_max(virt_name(ml), format.name_width); |
---|
478 | set_max(virt_fullname(ml), format.gene_or_full_width); |
---|
479 | set_max(GBS_global_string("%i", info2bio(ml->b_pos)), format.pos_width); |
---|
480 | if (show_gpos) set_max(GBS_global_string("%i", info2bio(ml->g_pos)), format.gpos_width); |
---|
481 | if (format.show_ecoli) set_max(GBS_global_string("%li", PT_abs_2_ecoli_rel(ml->b_pos+1)), format.ecoli_width); |
---|
482 | } |
---|
483 | |
---|
484 | return format; |
---|
485 | } |
---|
486 | |
---|
487 | inline void cat_internal(GBS_strstruct *memfile, int len, const char *text, int width, char spacer, bool align_left) { |
---|
488 | if (len == width) { |
---|
489 | GBS_strcat(memfile, text); // text has exact len |
---|
490 | } |
---|
491 | else if (len > width) { // text to long |
---|
492 | char buf[width+1]; |
---|
493 | memcpy(buf, text, width); |
---|
494 | buf[width] = 0; |
---|
495 | GBS_strcat(memfile, buf); |
---|
496 | } |
---|
497 | else { // text is too short -> insert spaces |
---|
498 | int spaces = width-len; |
---|
499 | pt_assert(spaces>0); |
---|
500 | char sp[spaces+1]; |
---|
501 | memset(sp, spacer, spaces); |
---|
502 | sp[spaces] = 0; |
---|
503 | |
---|
504 | if (align_left) { |
---|
505 | GBS_strcat(memfile, text); |
---|
506 | GBS_strcat(memfile, sp); |
---|
507 | } |
---|
508 | else { |
---|
509 | GBS_strcat(memfile, sp); |
---|
510 | GBS_strcat(memfile, text); |
---|
511 | } |
---|
512 | } |
---|
513 | GBS_chrcat(memfile, ' '); // one space behind each column |
---|
514 | } |
---|
515 | inline void cat_spaced_left (GBS_strstruct *memfile, const char *text, int width) { cat_internal(memfile, strlen(text), text, width, ' ', true); } |
---|
516 | inline void cat_spaced_right(GBS_strstruct *memfile, const char *text, int width) { cat_internal(memfile, strlen(text), text, width, ' ', false); } |
---|
517 | inline void cat_dashed_left (GBS_strstruct *memfile, const char *text, int width) { cat_internal(memfile, strlen(text), text, width, '-', true); } |
---|
518 | inline void cat_dashed_right(GBS_strstruct *memfile, const char *text, int width) { cat_internal(memfile, strlen(text), text, width, '-', false); } |
---|
519 | |
---|
520 | const char *get_match_overlay(const PT_probematch *ml) { |
---|
521 | int pr_len = strlen(ml->sequence); |
---|
522 | PT_local *locs = (PT_local *)ml->mh.parent->parent; |
---|
523 | |
---|
524 | const int CONTEXT_SIZE = 9; |
---|
525 | |
---|
526 | char *ref = ARB_calloc<char>(CONTEXT_SIZE+1+pr_len+1+CONTEXT_SIZE+1); |
---|
527 | memset(ref, '.', CONTEXT_SIZE+1); |
---|
528 | |
---|
529 | SmartCharPtr seqPtr = psg.data[ml->name].get_dataPtr(); |
---|
530 | const char *seq = &*seqPtr; |
---|
531 | |
---|
532 | const Splits& splits = splits_for_match_overlay[locs]; |
---|
533 | |
---|
534 | for (int pr_pos = CONTEXT_SIZE-1, al_pos = ml->rpos-1; |
---|
535 | pr_pos >= 0 && al_pos >= 0; |
---|
536 | pr_pos--, al_pos--) |
---|
537 | { |
---|
538 | if (!seq[al_pos]) break; |
---|
539 | ref[pr_pos] = base_2_readable(seq[al_pos]); |
---|
540 | } |
---|
541 | ref[CONTEXT_SIZE] = '-'; |
---|
542 | |
---|
543 | pt_build_pos_to_weight((PT_MATCH_TYPE)locs->sort_by, ml->sequence); |
---|
544 | |
---|
545 | bool display_right_context = true; |
---|
546 | { |
---|
547 | char *pref = ref+CONTEXT_SIZE+1; |
---|
548 | |
---|
549 | for (int pr_pos = 0, al_pos = ml->rpos; |
---|
550 | pr_pos < pr_len && al_pos < psg.data[ml->name].get_size(); |
---|
551 | pr_pos++, al_pos++) |
---|
552 | { |
---|
553 | int ps = ml->sequence[pr_pos]; // probe sequence |
---|
554 | int ts = seq[al_pos]; // target sequence (hit) |
---|
555 | if (ps == ts) { |
---|
556 | pref[pr_pos] = '='; |
---|
557 | } |
---|
558 | else { |
---|
559 | if (ts) { |
---|
560 | int r = base_2_readable(ts); |
---|
561 | if (is_std_base(ps) && is_std_base(ts)) { |
---|
562 | double h = splits.check(ml->sequence[pr_pos], ts); |
---|
563 | if (h>=0.0) r = tolower(r); // if mismatch does not split probe into two domains -> show as lowercase |
---|
564 | } |
---|
565 | pref[pr_pos] = r; |
---|
566 | } |
---|
567 | else { |
---|
568 | // end of sequence or missing data (dots inside sequence) reached |
---|
569 | // (rest of probe was accepted by N-matches) |
---|
570 | display_right_context = false; |
---|
571 | for (; pr_pos < pr_len; pr_pos++) { // LOOP_VECTORIZED[!<7,!910,!920] |
---|
572 | pref[pr_pos] = '.'; |
---|
573 | } |
---|
574 | } |
---|
575 | } |
---|
576 | |
---|
577 | } |
---|
578 | } |
---|
579 | |
---|
580 | { |
---|
581 | char *cref = ref+CONTEXT_SIZE+1+pr_len+1; |
---|
582 | cref[-1] = '-'; |
---|
583 | |
---|
584 | int al_size = psg.data[ml->name].get_size(); |
---|
585 | int al_pos = ml->rpos+pr_len; |
---|
586 | |
---|
587 | if (display_right_context) { |
---|
588 | for (int pr_pos = 0; |
---|
589 | pr_pos < CONTEXT_SIZE && al_pos < al_size; |
---|
590 | pr_pos++, al_pos++) |
---|
591 | { |
---|
592 | cref[pr_pos] = base_2_readable(seq[al_pos]); |
---|
593 | } |
---|
594 | } |
---|
595 | else { |
---|
596 | if (al_pos < al_size) strcpy(cref, "<more>"); |
---|
597 | } |
---|
598 | } |
---|
599 | |
---|
600 | static char *result = NULp; |
---|
601 | freeset(result, ref); |
---|
602 | return result; |
---|
603 | } |
---|
604 | |
---|
605 | const char* get_match_acc(const PT_probematch *ml) { |
---|
606 | return psg.data[ml->name].get_acc(); |
---|
607 | } |
---|
608 | int get_match_start(const PT_probematch *ml) { |
---|
609 | return psg.data[ml->name].get_start(); |
---|
610 | } |
---|
611 | int get_match_stop(const PT_probematch *ml) { |
---|
612 | return psg.data[ml->name].get_stop(); |
---|
613 | } |
---|
614 | |
---|
615 | static const char *get_match_info_formatted(PT_probematch *ml, const format_props& format) { |
---|
616 | GBS_strstruct *memfile = GBS_stropen(256); |
---|
617 | GBS_strcat(memfile, " "); |
---|
618 | |
---|
619 | cat_spaced_left(memfile, virt_name(ml), format.name_width); |
---|
620 | cat_spaced_left(memfile, virt_fullname(ml), format.gene_or_full_width); |
---|
621 | |
---|
622 | if (format.show_mismatches) { |
---|
623 | cat_spaced_right(memfile, GBS_global_string("%i", ml->mismatches), format.mis_width()); |
---|
624 | cat_spaced_right(memfile, GBS_global_string("%i", ml->N_mismatches), format.N_mis_width()); |
---|
625 | } |
---|
626 | cat_spaced_right(memfile, GBS_global_string("%.1f", ml->wmismatches), format.wmis_width()); |
---|
627 | cat_spaced_right(memfile, GBS_global_string("%i", info2bio(ml->b_pos)), format.pos_width); |
---|
628 | if (format.show_gpos) { |
---|
629 | cat_spaced_right(memfile, GBS_global_string("%i", info2bio(ml->g_pos)), format.gpos_width); |
---|
630 | } |
---|
631 | if (format.show_ecoli) { |
---|
632 | cat_spaced_right(memfile, GBS_global_string("%li", PT_abs_2_ecoli_rel(ml->b_pos+1)), format.ecoli_width); |
---|
633 | } |
---|
634 | cat_spaced_left(memfile, GBS_global_string("%i", ml->reversed), format.rev_width()); |
---|
635 | |
---|
636 | GBS_strcat(memfile, get_match_overlay(ml)); |
---|
637 | |
---|
638 | static char *result = NULp; |
---|
639 | freeset(result, GBS_strclose(memfile)); |
---|
640 | return result; |
---|
641 | } |
---|
642 | |
---|
643 | static const char *get_match_hinfo_formatted(PT_probematch *ml, const format_props& format) { |
---|
644 | if (ml) { |
---|
645 | GBS_strstruct *memfile = GBS_stropen(500); |
---|
646 | GBS_strcat(memfile, " "); // one space more than in get_match_info_formatted() |
---|
647 | |
---|
648 | cat_dashed_left(memfile, gene_flag ? "organism" : "name", format.name_width); |
---|
649 | cat_dashed_left(memfile, gene_flag ? "genename" : "fullname", format.gene_or_full_width); |
---|
650 | |
---|
651 | if (format.show_mismatches) { |
---|
652 | cat_dashed_right(memfile, "mis", format.mis_width()); |
---|
653 | cat_dashed_right(memfile, "N_mis", format.N_mis_width()); |
---|
654 | } |
---|
655 | cat_dashed_right(memfile, "wmis", format.wmis_width()); |
---|
656 | cat_dashed_right(memfile, "pos", format.pos_width); |
---|
657 | if (format.show_gpos) { |
---|
658 | cat_dashed_right(memfile, "gpos", format.gpos_width); |
---|
659 | } |
---|
660 | if (format.show_ecoli) { |
---|
661 | cat_dashed_right(memfile, "ecoli", format.ecoli_width); |
---|
662 | } |
---|
663 | cat_dashed_left(memfile, "rev", format.rev_width()); |
---|
664 | |
---|
665 | if (ml->N_mismatches >= 0) { // |
---|
666 | char *seq = ARB_strdup(ml->sequence); |
---|
667 | probe_2_readable(seq, strlen(ml->sequence)); // @@@ maybe wrong if match contains PT_QU (see [9070]) |
---|
668 | |
---|
669 | GBS_strcat(memfile, " '"); |
---|
670 | GBS_strcat(memfile, seq); |
---|
671 | GBS_strcat(memfile, "'"); |
---|
672 | |
---|
673 | free(seq); |
---|
674 | } |
---|
675 | |
---|
676 | static char *result = NULp; |
---|
677 | freeset(result, GBS_strclose(memfile)); |
---|
678 | return result; |
---|
679 | } |
---|
680 | // Else set header of result |
---|
681 | return "There are no targets"; |
---|
682 | } |
---|
683 | |
---|
684 | static void gene_rel_2_abs(PT_probematch *ml) { |
---|
685 | /*! after gene probe match all positions are gene-relative. |
---|
686 | * gene_rel_2_abs() makes them genome-absolute. |
---|
687 | */ |
---|
688 | |
---|
689 | GB_transaction ta(psg.gb_main); |
---|
690 | |
---|
691 | for (; ml; ml = ml->next) { |
---|
692 | long gene_pos = psg.data[ml->name].get_geneabspos(); |
---|
693 | if (gene_pos >= 0) { |
---|
694 | ml->g_pos = ml->b_pos; |
---|
695 | ml->b_pos += gene_pos; |
---|
696 | } |
---|
697 | else { |
---|
698 | fprintf(stderr, "Error in gene-pt-server: gene w/o position info\n"); |
---|
699 | pt_assert(0); |
---|
700 | } |
---|
701 | } |
---|
702 | } |
---|
703 | |
---|
704 | bytestring *match_string(const PT_local *locs) { |
---|
705 | /*! Create list of species where probe matches. |
---|
706 | * |
---|
707 | * header^1name^1info^1name^1info....^0 |
---|
708 | * (where ^0 and ^1 are ASCII 0 and 1) |
---|
709 | * |
---|
710 | * Implements server function 'MATCH_STRING' |
---|
711 | */ |
---|
712 | static bytestring bs = { NULp, 0 }; |
---|
713 | GBS_strstruct *memfile; |
---|
714 | PT_probematch *ml; |
---|
715 | |
---|
716 | free(bs.data); |
---|
717 | |
---|
718 | char empty[] = ""; |
---|
719 | bs.data = empty; |
---|
720 | memfile = GBS_stropen(50000); |
---|
721 | |
---|
722 | if (locs->pm) { |
---|
723 | if (gene_flag) gene_rel_2_abs(locs->pm); |
---|
724 | |
---|
725 | format_props format = detect_format_props(locs, gene_flag); |
---|
726 | |
---|
727 | GBS_strcat(memfile, get_match_hinfo_formatted(locs->pm, format)); |
---|
728 | GBS_chrcat(memfile, (char)1); |
---|
729 | |
---|
730 | for (ml = locs->pm; ml; ml = ml->next) { |
---|
731 | GBS_strcat(memfile, virt_name(ml)); |
---|
732 | GBS_chrcat(memfile, (char)1); |
---|
733 | GBS_strcat(memfile, get_match_info_formatted(ml, format)); |
---|
734 | GBS_chrcat(memfile, (char)1); |
---|
735 | } |
---|
736 | } |
---|
737 | |
---|
738 | bs.size = GBS_memoffset(memfile)+1; |
---|
739 | bs.data = GBS_strclose(memfile); |
---|
740 | return &bs; |
---|
741 | } |
---|
742 | |
---|
743 | |
---|
744 | |
---|
745 | |
---|
746 | bytestring *MP_match_string(const PT_local *locs) { |
---|
747 | /*! Create list of species where probe matches and append number of mismatches and weighted mismatches (used by multiprobe) |
---|
748 | * |
---|
749 | * Format: "header^1name^1#mismatches^1#wmismatches^1name^1#mismatches^1#wmismatches....^0" |
---|
750 | * (where ^0 and ^1 are ASCII 0 and 1) |
---|
751 | * |
---|
752 | * Implements server function 'MP_MATCH_STRING' |
---|
753 | */ |
---|
754 | static bytestring bs = { NULp, 0 }; |
---|
755 | |
---|
756 | char buffer[50]; |
---|
757 | char buffer1[50]; |
---|
758 | GBS_strstruct *memfile; |
---|
759 | PT_probematch *ml; |
---|
760 | |
---|
761 | delete bs.data; |
---|
762 | bs.data = NULp; |
---|
763 | memfile = GBS_stropen(50000); |
---|
764 | |
---|
765 | for (ml = locs->pm; ml; ml = ml->next) { |
---|
766 | GBS_strcat(memfile, virt_name(ml)); |
---|
767 | GBS_chrcat(memfile, (char)1); |
---|
768 | sprintf(buffer, "%2i", ml->mismatches); |
---|
769 | GBS_strcat(memfile, buffer); |
---|
770 | GBS_chrcat(memfile, (char)1); |
---|
771 | sprintf(buffer1, "%1.1f", ml->wmismatches); |
---|
772 | GBS_strcat(memfile, buffer1); |
---|
773 | GBS_chrcat(memfile, (char)1); |
---|
774 | } |
---|
775 | bs.size = GBS_memoffset(memfile)+1; |
---|
776 | bs.data = GBS_strclose(memfile); |
---|
777 | return &bs; |
---|
778 | } |
---|
779 | |
---|
780 | |
---|
781 | bytestring *MP_all_species_string(const PT_local *) { |
---|
782 | /*! Create list of all species known to PT server |
---|
783 | * |
---|
784 | * Format: ^1name^1name....^0 |
---|
785 | * (where ^0 and ^1 are ASCII 0 and 1) |
---|
786 | * |
---|
787 | * Implements server function 'MP_ALL_SPECIES_STRING' |
---|
788 | */ |
---|
789 | static bytestring bs = { NULp, 0 }; |
---|
790 | |
---|
791 | GBS_strstruct *memfile; |
---|
792 | int i; |
---|
793 | |
---|
794 | delete bs.data; |
---|
795 | bs.data = NULp; |
---|
796 | memfile = GBS_stropen(1000); |
---|
797 | |
---|
798 | for (i = 0; i < psg.data_count; i++) { |
---|
799 | GBS_strcat(memfile, psg.data[i].get_shortname()); |
---|
800 | GBS_chrcat(memfile, (char)1); |
---|
801 | } |
---|
802 | |
---|
803 | bs.size = GBS_memoffset(memfile)+1; |
---|
804 | bs.data = GBS_strclose(memfile); |
---|
805 | return &bs; |
---|
806 | } |
---|
807 | |
---|
808 | int MP_count_all_species(const PT_local *) { |
---|
809 | return psg.data_count; |
---|
810 | } |
---|
811 | |
---|
812 | // -------------------------------------------------------------------------------- |
---|
813 | |
---|
814 | #ifdef UNIT_TESTS |
---|
815 | #ifndef TEST_UNIT_H |
---|
816 | #include <test_unit.h> |
---|
817 | #endif |
---|
818 | |
---|
819 | struct EnterStage2 { |
---|
820 | EnterStage2() { |
---|
821 | PT_init_psg(); |
---|
822 | psg.enter_stage(STAGE2); |
---|
823 | } |
---|
824 | ~EnterStage2() { |
---|
825 | PT_exit_psg(); |
---|
826 | } |
---|
827 | }; |
---|
828 | |
---|
829 | #define TEST_WEIGHTED_MISMATCH(probe,seq,expected) TEST_EXPECT_SIMILAR(weights.get(probe,seq), expected, EPS) |
---|
830 | |
---|
831 | void TEST_weighted_mismatches() { |
---|
832 | EnterStage2 stage2; |
---|
833 | PT_bond bonds[16] = { |
---|
834 | { 0.0 }, { 0.0 }, { 0.5 }, { 1.1 }, |
---|
835 | { 0.0 }, { 0.0 }, { 1.5 }, { 0.0 }, |
---|
836 | { 0.5 }, { 1.5 }, { 0.4 }, { 0.9 }, |
---|
837 | { 1.1 }, { 0.0 }, { 0.9 }, { 0.0 }, |
---|
838 | }; |
---|
839 | |
---|
840 | MismatchWeights weights(bonds); |
---|
841 | |
---|
842 | double EPS = 0.0001; |
---|
843 | |
---|
844 | TEST_WEIGHTED_MISMATCH(PT_A, PT_A, 0.0); |
---|
845 | TEST_WEIGHTED_MISMATCH(PT_A, PT_C, 1.1); // (T~A = 1.1) - (T~C = 0) |
---|
846 | TEST_WEIGHTED_MISMATCH(PT_A, PT_G, 0.2); // (T~A = 1.1) - (T~G = 0.9) |
---|
847 | TEST_WEIGHTED_MISMATCH(PT_A, PT_T, 1.1); |
---|
848 | |
---|
849 | TEST_WEIGHTED_MISMATCH(PT_C, PT_A, 1.0); |
---|
850 | TEST_WEIGHTED_MISMATCH(PT_C, PT_C, 0.0); |
---|
851 | TEST_WEIGHTED_MISMATCH(PT_C, PT_G, 1.1); |
---|
852 | TEST_WEIGHTED_MISMATCH(PT_C, PT_T, 0.6); // (G~C = 1.5) - (G~T = 0.9) |
---|
853 | |
---|
854 | TEST_WEIGHTED_MISMATCH(PT_G, PT_A, 1.5); |
---|
855 | TEST_WEIGHTED_MISMATCH(PT_G, PT_C, 1.5); |
---|
856 | TEST_WEIGHTED_MISMATCH(PT_G, PT_G, 0.0); |
---|
857 | TEST_WEIGHTED_MISMATCH(PT_G, PT_T, 1.5); |
---|
858 | |
---|
859 | TEST_WEIGHTED_MISMATCH(PT_T, PT_A, 1.1); |
---|
860 | TEST_WEIGHTED_MISMATCH(PT_T, PT_C, 1.1); |
---|
861 | TEST_WEIGHTED_MISMATCH(PT_T, PT_G, 0.6); |
---|
862 | TEST_WEIGHTED_MISMATCH(PT_T, PT_T, 0.0); |
---|
863 | |
---|
864 | |
---|
865 | TEST_WEIGHTED_MISMATCH(PT_N, PT_A, 0.9); |
---|
866 | TEST_WEIGHTED_MISMATCH(PT_N, PT_C, 0.925); |
---|
867 | TEST_WEIGHTED_MISMATCH(PT_N, PT_G, 0.475); |
---|
868 | TEST_WEIGHTED_MISMATCH(PT_N, PT_T, 0.8); |
---|
869 | |
---|
870 | TEST_WEIGHTED_MISMATCH(PT_A, PT_N, 0.6); |
---|
871 | TEST_WEIGHTED_MISMATCH(PT_C, PT_N, 0.675); |
---|
872 | TEST_WEIGHTED_MISMATCH(PT_G, PT_N, 1.125); |
---|
873 | TEST_WEIGHTED_MISMATCH(PT_T, PT_N, 0.7); |
---|
874 | |
---|
875 | TEST_WEIGHTED_MISMATCH(PT_N, PT_N, 0.775); |
---|
876 | TEST_WEIGHTED_MISMATCH(PT_QU, PT_QU, 0.775); |
---|
877 | TEST_WEIGHTED_MISMATCH(PT_QU, PT_N, 0.775); |
---|
878 | } |
---|
879 | |
---|
880 | #endif // UNIT_TESTS |
---|
881 | |
---|
882 | // -------------------------------------------------------------------------------- |
---|
883 | |
---|
884 | |
---|
885 | |
---|