1 | // =============================================================== // |
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2 | // // |
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3 | // File : awtc_seq_search.hxx // |
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4 | // Purpose : Fast sequence search for fast aligner // |
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5 | // // |
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6 | // Coded by Ralf Westram (coder@reallysoft.de) in July 1998 // |
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7 | // Institute of Microbiology (Technical University Munich) // |
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8 | // http://www.arb-home.de/ // |
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9 | // // |
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10 | // =============================================================== // |
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11 | |
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12 | #ifndef AWTC_SEQ_SEARCH_HXX |
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13 | #define AWTC_SEQ_SEARCH_HXX |
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14 | |
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15 | #ifndef _CPP_CSTRING |
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16 | #include <cstring> |
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17 | #endif |
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18 | #ifndef _CPP_CSTDLIB |
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19 | #include <cstdlib> |
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20 | #endif |
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21 | |
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22 | #ifndef AW_ROOT_HXX |
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23 | #include <aw_root.hxx> |
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24 | #endif |
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25 | #ifndef ARB_ASSERT_H |
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26 | #include <arb_assert.h> |
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27 | #endif |
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28 | #define awtc_assert(bed) arb_assert(bed) |
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29 | |
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30 | #define SEQ_CHARS 26 |
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31 | #define MAX_TRIPLES (SEQ_CHARS*SEQ_CHARS*SEQ_CHARS+1) // one faked triple for all non-char triples |
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32 | #define GAP_CHARS ".-~?" // Characters treated as gaps |
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33 | |
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34 | void AWTC_message(const char *format, ...) __ATTR__FORMAT(1); |
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35 | |
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36 | static inline int max(int i1, int i2) { return i1>i2 ? i1 : i2; } |
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37 | static inline int AWTC_is_gap(int c) { return strchr(GAP_CHARS, c)!=0; } |
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38 | |
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39 | class AWTC_CompactedSubSequence; |
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40 | |
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41 | class AWTC_Points // here we store points ('.') which were deleted when compacting sequences |
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42 | { |
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43 | long BeforeBase; // this position is the "compressed" position |
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44 | AWTC_Points *Next; |
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45 | |
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46 | public: |
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47 | |
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48 | AWTC_Points(long before_base) { |
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49 | BeforeBase = before_base; |
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50 | Next = NULL; |
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51 | } |
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52 | ~AWTC_Points() { |
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53 | delete Next; |
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54 | } |
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55 | |
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56 | void append(AWTC_Points *neu); |
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57 | long beforeBase(void) const { return BeforeBase; } |
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58 | const AWTC_Points *next(void) const { return Next; } |
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59 | }; |
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60 | |
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61 | class AWTC_CompactedSequence // compacts a string (gaps removed, all chars upper) |
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62 | // (private class - use AWTC_CompactedSubSequence) |
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63 | { |
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64 | char *myText; |
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65 | int myLength; // number of base positions |
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66 | int myStartOffset; // expanded offsets of first and last position in 'text' (which is given to the c-tor) |
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67 | int myEndOffset; |
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68 | int *expdPositionTab; // this table contains all 'real' (=not compacted) positions of the bases (len = myLength+1) |
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69 | |
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70 | int *gapsBeforePosition; // gapsBeforePosition[ idx+1 ] = gaps _after_ position 'idx' |
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71 | int referred; |
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72 | |
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73 | char *myName; // sequence name |
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74 | |
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75 | AWTC_Points *points; // Points which were deleted from the sequence are store here |
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76 | |
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77 | // ----------------------------------------- |
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78 | |
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79 | AWTC_CompactedSequence(const char *text, int length, const char *name, int start_offset=0); |
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80 | ~AWTC_CompactedSequence(); |
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81 | |
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82 | int length() const {return myLength;} |
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83 | const char *text(int i=0) const {return myText+i;} |
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84 | |
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85 | char operator[](int i) const {if (i<0 || i>=length()) i = 0; else i = text()[i]; return i;} // HP compiler does not allow two returns |
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86 | |
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87 | int expdPosition(int cPos) const { |
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88 | awtc_assert(cPos>=0 && cPos<=myLength); // allowed for all positions plus one following element |
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89 | ; // (which contains the total length of the original sequence) |
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90 | return expdPositionTab[cPos]+myStartOffset; |
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91 | } |
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92 | int compPosition(int xPos) const; |
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93 | |
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94 | int no_of_gaps_before(int cPos) const { |
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95 | int leftMostGap; |
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96 | if (cPos>0) { |
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97 | leftMostGap = expdPosition(cPos-1)+1; |
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98 | } |
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99 | else { |
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100 | leftMostGap = myStartOffset; |
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101 | } |
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102 | return expdPosition(cPos)-leftMostGap; |
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103 | } |
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104 | int no_of_gaps_after(int cPos) const { |
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105 | int rightMostGap; |
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106 | if (cPos<(length()-1)) { |
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107 | rightMostGap = expdPosition(cPos+1)-1; |
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108 | } |
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109 | else { |
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110 | rightMostGap = myEndOffset; |
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111 | } |
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112 | return rightMostGap-expdPosition(cPos); |
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113 | } |
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114 | |
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115 | void storePoints(int beforePos) { |
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116 | if (points) points->append(new AWTC_Points(beforePos)); |
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117 | else points = new AWTC_Points(beforePos); |
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118 | } |
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119 | |
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120 | friend class AWTC_CompactedSubSequence; |
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121 | |
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122 | public: |
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123 | |
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124 | const AWTC_Points *getPointlist(void) const { return points; } |
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125 | }; |
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126 | |
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127 | class AWTC_CompactedSubSequence // smart pointer and substring class for AWTC_CompactedSequence |
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128 | { |
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129 | AWTC_CompactedSequence *mySequence; |
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130 | int myPos; // offset into mySequence->myText |
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131 | int myLength; // number of base positions |
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132 | const char *myText; // only for speed-up |
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133 | const AWTC_Points *points; // just a reference |
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134 | |
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135 | public: |
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136 | |
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137 | AWTC_CompactedSubSequence(const char *seq, int length, const char *name, int start_offset=0); // normal c-tor |
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138 | AWTC_CompactedSubSequence(const AWTC_CompactedSubSequence& other); |
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139 | AWTC_CompactedSubSequence(const AWTC_CompactedSubSequence& other, int rel_pos, int length); // substr c-tor |
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140 | ~AWTC_CompactedSubSequence(); // d-tor |
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141 | AWTC_CompactedSubSequence& operator=(const AWTC_CompactedSubSequence& other); // =-c-tor |
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142 | |
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143 | int length() const {return myLength;} |
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144 | |
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145 | const char *text() const { return myText; } |
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146 | const char *text(int i) const { return text()+i; } |
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147 | |
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148 | const char *name() const { return mySequence->myName; } |
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149 | |
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150 | char operator[](int i) const { if (i<0 || i>=length()) { i= 0; } else { i = text()[i]; } return i; } |
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151 | |
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152 | int no_of_gaps_before(int cPos) const { return mySequence->no_of_gaps_before(myPos+cPos); } |
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153 | int no_of_gaps_after(int cPos) const { return mySequence->no_of_gaps_after(myPos+cPos); } |
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154 | |
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155 | int expdStartPosition() const { return mySequence->expdPosition(myPos); } |
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156 | int expdPosition(int cPos) const |
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157 | { |
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158 | awtc_assert(cPos>=0 && cPos<=myLength); // allowed for all positions plus follower |
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159 | return mySequence->expdPosition(myPos+cPos); |
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160 | } |
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161 | int compPosition(int xPos) const { return mySequence->compPosition(xPos)-myPos; } |
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162 | int expdLength() const { return expdPosition(length()-1); } |
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163 | const int *gapsBefore(int offset=0) const { return mySequence->gapsBeforePosition + myPos + offset; } |
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164 | |
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165 | int thisPointPosition(void) { |
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166 | int pos = points->beforeBase()-myPos; |
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167 | |
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168 | if (pos>(myLength+1)) { |
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169 | points = NULL; |
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170 | pos = -1; // HP Compiler !! |
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171 | } |
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172 | |
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173 | return pos; |
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174 | } |
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175 | |
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176 | int firstPointPosition(void) // HP Compiler needs res |
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177 | { |
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178 | points = mySequence->getPointlist(); |
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179 | int res = -1; |
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180 | |
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181 | while (points && points->beforeBase()<myPos) { |
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182 | points = points->next(); |
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183 | } |
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184 | if (points){ |
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185 | res = thisPointPosition(); |
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186 | } |
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187 | |
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188 | return res; |
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189 | } |
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190 | |
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191 | int nextPointPosition(void) // HP Compiler !!! |
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192 | { |
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193 | int res = -1; |
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194 | if (points){ |
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195 | points = points->next(); |
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196 | } |
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197 | if (points){ |
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198 | res = thisPointPosition(); |
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199 | } |
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200 | return res; |
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201 | } |
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202 | }; |
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203 | |
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204 | class AWTC_SequencePosition // pointer to character position in AWTC_CompactedSubSequence |
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205 | { |
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206 | const AWTC_CompactedSubSequence *mySequence; |
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207 | long myPos; |
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208 | const char *myText; |
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209 | |
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210 | int distanceTo(const AWTC_SequencePosition& other) const {awtc_assert(mySequence==other.mySequence); return myPos-other.myPos;} |
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211 | |
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212 | public: |
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213 | |
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214 | AWTC_SequencePosition(const AWTC_CompactedSubSequence& seq, long pos=0) |
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215 | : mySequence(&seq), |
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216 | myPos(pos), |
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217 | myText(seq.text(pos)) {} |
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218 | AWTC_SequencePosition(const AWTC_SequencePosition& pos, long offset=0) |
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219 | : mySequence(pos.mySequence), |
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220 | myPos(pos.myPos+offset), |
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221 | myText(pos.myText+offset) {} |
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222 | ~AWTC_SequencePosition() {} |
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223 | |
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224 | const char *text() const { return myText;} |
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225 | const AWTC_CompactedSubSequence& sequence() const { return *mySequence;} |
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226 | |
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227 | long expdPosition() const { return sequence().expdPosition(myPos); } |
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228 | long expdPosition(int offset) { return sequence().expdPosition(myPos+offset); } |
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229 | |
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230 | AWTC_SequencePosition& operator++() { myPos++; myText++; return *this; } |
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231 | AWTC_SequencePosition& operator--() { myPos--; myText--; return *this; } |
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232 | |
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233 | AWTC_SequencePosition& operator+=(long l) { myPos += l; myText += l; return *this; } |
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234 | AWTC_SequencePosition& operator-=(long l) { myPos -= l; myText -= l; return *this; } |
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235 | |
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236 | int operator<(const AWTC_SequencePosition& other) const { return distanceTo(other)<0; } |
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237 | int operator>(const AWTC_SequencePosition& other) const { return distanceTo(other)>0; } |
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238 | |
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239 | long leftOf() const { return myPos;} |
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240 | long rightOf() const { return mySequence->length()-myPos;} |
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241 | }; |
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242 | |
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243 | class AWTC_TripleOffset // a list of offsets (used in AWTC_FastSearchSequence) |
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244 | { |
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245 | long myOffset; // compacted offset |
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246 | AWTC_TripleOffset *myNext; |
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247 | |
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248 | void IV() const {awtc_assert(myNext!=this);} |
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249 | |
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250 | public: |
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251 | |
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252 | AWTC_TripleOffset(long Offset, AWTC_TripleOffset *next_toff) : myOffset(Offset), myNext(next_toff) { IV(); } |
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253 | ~AWTC_TripleOffset(); |
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254 | |
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255 | AWTC_TripleOffset *next() const { IV(); return myNext; } |
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256 | long offset() const { IV(); return myOffset; } |
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257 | }; |
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258 | |
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259 | |
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260 | class AWTC_alignBuffer // alignment result buffer |
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261 | { |
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262 | char *myBuffer; |
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263 | char *myQuality; |
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264 | |
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265 | // myQuality contains the following chars: |
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266 | // |
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267 | // '?' base was just inserted (not aligned) |
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268 | // '-' master and slave are equal |
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269 | // '+' gap in masert excl-or slave |
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270 | // '~' master base and slave base are related |
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271 | // '#' master base and slave base are NOT related (mismatch) |
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272 | |
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273 | long mySize; |
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274 | long used; |
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275 | |
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276 | void set_used(long newVal) |
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277 | { |
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278 | awtc_assert(newVal<=mySize); |
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279 | used = newVal; |
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280 | GB_status(double(used)/double(mySize)); |
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281 | } |
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282 | void add_used(long toAdd) |
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283 | { |
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284 | set_used(toAdd+used); |
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285 | } |
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286 | |
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287 | int isGlobalGap(long off) // TRUE if gap in slave AND master |
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288 | { |
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289 | return (myBuffer[off]=='-' || myBuffer[off]=='.') && myQuality[off]=='-'; |
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290 | } |
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291 | void moveUnaligned(long from, long to) |
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292 | { |
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293 | myBuffer[to] = myBuffer[from]; |
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294 | myQuality[to] = myQuality[from]; |
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295 | myBuffer[from] = '-'; |
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296 | myQuality[from] = '-'; |
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297 | } |
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298 | |
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299 | public: |
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300 | |
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301 | AWTC_alignBuffer(long size) |
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302 | { |
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303 | mySize = size; |
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304 | set_used(0); |
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305 | myBuffer = new char[size+1]; |
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306 | myBuffer[size] = 0; |
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307 | myQuality = new char[size+1]; |
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308 | myQuality[size] = 0; |
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309 | } |
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310 | ~AWTC_alignBuffer() |
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311 | { |
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312 | delete [] myBuffer; |
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313 | delete [] myQuality; |
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314 | } |
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315 | |
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316 | const char *text() const { awtc_assert(free()>=0); myBuffer[used]=0; return myBuffer; } |
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317 | const char *quality() const { awtc_assert(free()>=0); myQuality[used]=0; return myQuality; } |
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318 | long length() const { return used; } |
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319 | |
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320 | long offset() const { return used; } |
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321 | long free() const { return mySize-used; } |
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322 | |
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323 | void copy(const char *s, char q, long len) |
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324 | { |
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325 | awtc_assert(len<=free()); |
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326 | memcpy(myBuffer+used, s, len); |
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327 | memset(myQuality+used, q, len); |
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328 | add_used(len); |
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329 | } |
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330 | void set(char c, char q) |
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331 | { |
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332 | awtc_assert(free()>=1); |
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333 | myBuffer[used] = c; |
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334 | myQuality[used] = q; |
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335 | add_used(1); |
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336 | } |
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337 | void set(char c, char q, long len) |
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338 | { |
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339 | awtc_assert(len<=free()); |
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340 | memset(myBuffer+used, c, len); |
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341 | memset(myQuality+used, q, len); |
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342 | add_used(len); |
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343 | } |
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344 | void reset(long newOffset=0) |
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345 | { |
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346 | awtc_assert(newOffset>=0 && newOffset<mySize); |
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347 | set_used(newOffset); |
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348 | } |
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349 | |
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350 | void correctUnalignedPositions(void); |
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351 | |
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352 | void expandPoints(AWTC_CompactedSubSequence& slaveSequence); |
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353 | void point_ends_of(); |
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354 | }; |
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355 | |
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356 | |
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357 | class AWTC_fast_align_insertion |
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358 | { |
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359 | long insert_at_offset; |
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360 | long inserted_gaps; |
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361 | |
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362 | AWTC_fast_align_insertion *myNext; |
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363 | |
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364 | public: |
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365 | AWTC_fast_align_insertion(long Offset, long Gaps) { |
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366 | insert_at_offset = Offset; |
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367 | inserted_gaps = Gaps; |
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368 | myNext = 0; |
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369 | } |
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370 | ~AWTC_fast_align_insertion(); |
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371 | |
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372 | AWTC_fast_align_insertion *append(long Offset, long Gaps) { |
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373 | return myNext = new AWTC_fast_align_insertion(Offset, Gaps); |
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374 | } |
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375 | void dump() const { |
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376 | printf(" offset=%5li gaps=%3li\n", insert_at_offset, inserted_gaps); |
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377 | } |
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378 | void dumpAll() const { |
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379 | dump(); |
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380 | if (myNext) myNext->dumpAll(); |
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381 | } |
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382 | |
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383 | const AWTC_fast_align_insertion *next() const { return myNext; } |
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384 | long offset() const { return insert_at_offset; } |
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385 | long gaps() const { return inserted_gaps; } |
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386 | }; |
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387 | |
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388 | |
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389 | class AWTC_fast_align_report // alignment report |
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390 | { |
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391 | long alignedBases; |
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392 | long mismatchedBases; // in aligned part |
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393 | long unalignedBases; |
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394 | char *my_master_name; |
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395 | bool showGapsMessages; // display messages about missing gaps in master |
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396 | |
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397 | AWTC_fast_align_insertion *first; // list of insertions (order is important) |
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398 | AWTC_fast_align_insertion *last; |
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399 | |
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400 | public: |
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401 | |
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402 | AWTC_fast_align_report(const char *master_name, bool show_Gaps_Messages) { |
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403 | alignedBases = 0; |
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404 | mismatchedBases = 0; |
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405 | unalignedBases = 0; |
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406 | first = 0; |
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407 | last = 0; |
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408 | my_master_name = strdup(master_name); |
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409 | showGapsMessages = show_Gaps_Messages; |
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410 | } |
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411 | ~AWTC_fast_align_report() { |
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412 | if (first) delete first; |
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413 | free(my_master_name); |
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414 | } |
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415 | |
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416 | void memorize_insertion(long offset, long gaps) { |
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417 | if (last) { |
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418 | last = last->append(offset,gaps); |
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419 | } |
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420 | else { |
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421 | if (showGapsMessages) aw_message("---- gaps needed."); |
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422 | first = last = new AWTC_fast_align_insertion(offset, gaps); |
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423 | } |
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424 | |
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425 | if (showGapsMessages) { |
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426 | char *messi = (char*)malloc(100); |
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427 | |
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428 | sprintf(messi, "'%s' needs %li gaps at offset %li.", my_master_name, gaps, offset+1); |
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429 | aw_message(messi); |
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430 | free(messi); |
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431 | } |
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432 | } |
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433 | |
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434 | const AWTC_fast_align_insertion* insertion() const { return first; } |
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435 | |
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436 | void count_aligned_base(int mismatched) {alignedBases++; if (mismatched) mismatchedBases++;} |
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437 | void count_unaligned_base(int no_of_bases) {unalignedBases += no_of_bases;} |
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438 | |
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439 | void dump() const { |
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440 | printf("fast_align_report:\n" |
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441 | " alignedBases = %li (=%f%%)\n" |
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442 | " mismatchedBases = %li\n" |
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443 | " unalignedBases = %li\n" |
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444 | "inserts in master-sequence:\n", |
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445 | alignedBases, (float)alignedBases/(alignedBases+unalignedBases), |
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446 | mismatchedBases, |
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447 | unalignedBases); |
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448 | if (first) first->dumpAll(); |
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449 | } |
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450 | }; |
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451 | |
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452 | class AWTC_FastSearchSequence // a sequence where search of character triples is very fast |
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453 | { |
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454 | const AWTC_CompactedSubSequence *mySequence; |
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455 | AWTC_TripleOffset *myOffset[MAX_TRIPLES]; |
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456 | |
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457 | AWTC_FastSearchSequence(const AWTC_FastSearchSequence&) {} // not allowed |
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458 | AWTC_FastSearchSequence& operator=(const AWTC_FastSearchSequence&) { return *this; } // not allowed |
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459 | |
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460 | static int triple_index(const char *triple) |
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461 | { |
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462 | int idx = (int)(triple[0]-'A')*SEQ_CHARS*SEQ_CHARS + (int)(triple[1]-'A')*SEQ_CHARS + (triple[2]-'A'); |
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463 | |
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464 | return idx>=0 && idx<MAX_TRIPLES ? idx : MAX_TRIPLES-1; |
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465 | |
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466 | // if we got any non A-Z characters in sequence, the triple value may overflow. |
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467 | // we use (MAX_TRIPLES-1) as index for all illegal indices. |
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468 | } |
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469 | |
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470 | public: |
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471 | |
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472 | AWTC_FastSearchSequence(const AWTC_CompactedSubSequence& seq); |
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473 | ~AWTC_FastSearchSequence() {} |
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474 | |
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475 | GB_ERROR fast_align(const AWTC_CompactedSubSequence& align_to, AWTC_alignBuffer *alignBuffer, |
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476 | int max_seq_length, int matchScore, int mismatchScore, |
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477 | AWTC_fast_align_report *report) const; |
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478 | |
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479 | const AWTC_CompactedSubSequence& sequence() const {return *mySequence;} |
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480 | const AWTC_TripleOffset *find(const char *triple) const { return myOffset[triple_index(triple)]; } |
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481 | }; |
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482 | |
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483 | |
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484 | class AWTC_FastSearchOccurrence // iterates through all Occurances of one character triple |
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485 | { |
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486 | const AWTC_FastSearchSequence& mySequence; |
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487 | const AWTC_TripleOffset *myOffset; |
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488 | |
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489 | void IV() const {awtc_assert(!myOffset || myOffset!=myOffset->next());} |
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490 | |
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491 | public: |
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492 | |
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493 | AWTC_FastSearchOccurrence(const AWTC_FastSearchSequence& Sequence, const char *triple) |
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494 | : mySequence(Sequence) { myOffset = mySequence.find(triple); IV();} |
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495 | ~AWTC_FastSearchOccurrence() { IV();} |
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496 | |
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497 | int found() const { IV(); return myOffset!=0; } |
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498 | void gotoNext() { awtc_assert(myOffset!=0); myOffset = myOffset->next(); IV(); } |
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499 | |
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500 | long offset() const { IV(); return myOffset->offset();} |
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501 | const AWTC_CompactedSubSequence& sequence() const { IV(); return mySequence.sequence();} |
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502 | }; |
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503 | |
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504 | // ----------------------------- |
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505 | // INLINE-Functions: |
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506 | // ----------------------------- |
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507 | |
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508 | inline AWTC_CompactedSubSequence::AWTC_CompactedSubSequence(const char *seq, int len, const char *Name, int start_offset) // normal c-tor |
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509 | { |
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510 | mySequence = new AWTC_CompactedSequence(seq, len, Name, start_offset); |
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511 | myPos = 0; |
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512 | myLength = mySequence->length(); |
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513 | myText = mySequence->text()+myPos; |
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514 | } |
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515 | |
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516 | inline AWTC_CompactedSubSequence::AWTC_CompactedSubSequence(const AWTC_CompactedSubSequence& other) |
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517 | { |
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518 | mySequence = other.mySequence; |
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519 | mySequence->referred++; |
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520 | |
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521 | myPos = other.myPos; |
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522 | myLength = other.myLength; |
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523 | myText = other.myText; |
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524 | } |
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525 | |
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526 | inline AWTC_CompactedSubSequence::AWTC_CompactedSubSequence(const AWTC_CompactedSubSequence& other, int rel_pos, int Length) |
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527 | // substr c-tor |
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528 | { |
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529 | mySequence = other.mySequence; |
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530 | mySequence->referred++; |
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531 | |
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532 | myPos = other.myPos+rel_pos; |
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533 | myLength = Length; |
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534 | myText = mySequence->text()+myPos; |
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535 | |
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536 | //printf("work on sub-seq: %li-%li\n", pos, pos+length-1); |
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537 | |
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538 | awtc_assert((rel_pos+Length)<=mySequence->length()); |
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539 | awtc_assert(rel_pos>=0); |
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540 | } |
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541 | |
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542 | inline AWTC_CompactedSubSequence::~AWTC_CompactedSubSequence() // d-tor |
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543 | { |
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544 | if (mySequence->referred-- == 1) // last reference |
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545 | delete mySequence; |
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546 | } |
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547 | |
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548 | inline AWTC_CompactedSubSequence& AWTC_CompactedSubSequence::operator=(const AWTC_CompactedSubSequence& other) // =-c-tor |
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549 | { |
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550 | // d-tor part |
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551 | |
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552 | if (mySequence->referred-- == 1) |
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553 | delete mySequence; |
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554 | |
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555 | // c-tor part |
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556 | |
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557 | mySequence = other.mySequence; |
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558 | mySequence->referred++; |
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559 | |
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560 | myPos = other.myPos; |
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561 | myLength = other.myLength; |
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562 | myText = mySequence->text()+myPos; |
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563 | |
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564 | return *this; |
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565 | } |
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566 | |
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567 | #else |
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568 | #error awtc_seq_search.hxx included twice |
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569 | #endif // AWTC_SEQ_SEARCH_HXX |
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