File: simqual.c

package info (click to toggle)
smalt 0.7.6-13
  • links: PTS, VCS
  • area: main
  • in suites: forky, sid, trixie
  • size: 72,824 kB
  • sloc: ansic: 26,340; sh: 3,826; python: 1,472; makefile: 323
file content (271 lines) | stat: -rw-r--r-- 9,250 bytes parent folder | download | duplicates (6)
1
2
3
4
5
6
7
8
9
10
11
12
13
14
15
16
17
18
19
20
21
22
23
24
25
26
27
28
29
30
31
32
33
34
35
36
37
38
39
40
41
42
43
44
45
46
47
48
49
50
51
52
53
54
55
56
57
58
59
60
61
62
63
64
65
66
67
68
69
70
71
72
73
74
75
76
77
78
79
80
81
82
83
84
85
86
87
88
89
90
91
92
93
94
95
96
97
98
99
100
101
102
103
104
105
106
107
108
109
110
111
112
113
114
115
116
117
118
119
120
121
122
123
124
125
126
127
128
129
130
131
132
133
134
135
136
137
138
139
140
141
142
143
144
145
146
147
148
149
150
151
152
153
154
155
156
157
158
159
160
161
162
163
164
165
166
167
168
169
170
171
172
173
174
175
176
177
178
179
180
181
182
183
184
185
186
187
188
189
190
191
192
193
194
195
196
197
198
199
200
201
202
203
204
205
206
207
208
209
210
211
212
213
214
215
216
217
218
219
220
221
222
223
224
225
226
227
228
229
230
231
232
233
234
235
236
237
238
239
240
241
242
243
244
245
246
247
248
249
250
251
252
253
254
255
256
257
258
259
260
261
262
263
264
265
266
267
268
269
270
271
/**< Simulate base qualities for a set of reads. 
 * Original reads are modified according to base qualities.
 *
 * Statistics on base qualities must have been collected using
 * basqcol.c
 */

/****************************************************************************
 ****************************************************************************
 *                                                                          *
 *  Copyright (C) 2010-2014 Genome Research Ltd.                            * 
 *                                                                          *        
 *  Author: Hannes Ponstingl (hp3@sanger.ac.uk)                             *
 *                                                                          *
 *  This file is part of SMALT                                              *
 *                                                                          *
 *  SMALT is free software: you can redistribute it and/or modify it under  *
 *  the terms of the GNU General Public License as published by the Free    *
 *  Software Foundation, either version 3 of the License, or (at your       *
 *  option) any later version.                                              *
 *                                                                          *
 *  This program is distributed in the hope that it will be useful, but     *
 *  WITHOUT ANY WARRANTY; without even the implied warranty of              *
 *  MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE. See the GNU        *
 *  General Public License for more details.                                *
 *                                                                          *
 *  You should have received a copy of the GNU General Public License along *
 *  with this program.  If not, see <http://www.gnu.org/licenses/>.         *
 *                                                                          *
 ****************************************************************************
 ****************************************************************************/

#include <stdio.h>
#include <stdlib.h>
#include <limits.h>
#include <stdint.h>
#include <ctype.h>
#include <string.h>
#include <math.h>

#include "elib.h"
#include "randef.h"
#include "sequence.h"
#include "diffstr.h"
#include "basqual.h"

enum {
  NAMBUF_MAXLEN = 4096,
  NAMSIZ_PER_MUTREC = 20, /**< allow this many characters for 1 mutation in string */
  PHRED_SCALE = 10,
  PHRED_LOGBASE = 10,
};

static int mutateNtSeq(SeqFastq *sqp, 
		       int *mutreclen, char *mutchar, int *mutpos, 
		       const SeqCodec *codecp)
     /**< Mutate nuclotide sequence randomly with rates given by the base qualities. 
      * \param sqp Sequence to be mutated (with base qualities)
      * \param mutreclen Returns the number of bases mutated (can be NULL).
      * \param mutchar array returning the original bases 
      *        of each mutation (must have been pre-allocated, can be NULL).
      * \param mutpos array returning the position 
      *        of each mutation (must have been pre_allocated, can be NULL).
      */
{
  char *qualp, *basp, cod;
  short alphlen, encodsiz;
  int modi, stdnt_idx, bq;
  SEQLEN_t i, rlen;
  double errprob, randunit;
  const char *alphabetp = seqCodecGetAlphabet(codecp, &alphlen);
  const unsigned char *encoderp = seqCodecGetEncoder(codecp, &encodsiz);
  const double phredexp = -1*log(PHRED_LOGBASE)/PHRED_SCALE;
  int n_mutrecord = 0;

  if (SEQCOD_STDNT_MASK >= alphlen)
    return ERRCODE_ASSERT;
  if (mutreclen) *mutreclen = 0;
  basp = seqFastqGetSequence(sqp, &rlen, &cod);
  if (cod != SEQCOD_ASCII)
    return ERRCODE_SEQCODE;
  qualp = seqFastqGetQualityFactors(sqp, &rlen, NULL);

  if (rlen > INT_MAX)
    return ERRCODE_OVERFLOW;

  for (i=0; i<rlen; i++) {
    bq = ((int) qualp[i]) - SEQCOD_QVAL_OFFS;
    if (bq < 0) 
      return ERRCODE_ASSERT;
    if (bq == 0) 
      continue;
    errprob = exp(phredexp*bq);
    randunit = RANDRAW_UNIFORM_1();
    if (randunit > errprob)
      continue;
    modi = (int) (randunit*SEQCOD_STDNT_MASK/errprob);
    if (modi + 1 > SEQCOD_STDNT_MASK)
      modi = SEQCOD_STDNT_MASK - 1;
    else if (modi < 0)
      modi = 0;
    
    if (basp[i] >= encodsiz)
      return ERRCODE_ASSERT;

    if (mutchar) mutchar[n_mutrecord] = basp[i];
    if (mutpos) mutpos[n_mutrecord] = (int) i;
    n_mutrecord++;
    stdnt_idx = ((encoderp[(int) basp[i]] & SEQCOD_STDNT_MASK) + modi) % (SEQCOD_STDNT_MASK + 1);
    basp[i] = alphabetp[stdnt_idx];
  }
 
  if (mutreclen) *mutreclen = n_mutrecord;
  return ERRCODE_SUCCESS;
}

int main(int argc, char *argv[])
{
  int errcode = EXIT_SUCCESS;
  char nambuf[NAMBUF_MAXLEN];
  char *qualp, *mutbasp;
  char *filnam_basq, *filnam_fastq_in, *filnam_fastq_out;
  int is_modify;
  uint8_t nqual, qmin;
  int rand_seed;
  SEQLEN_t rlen, rlen_simulated;
  int *mutposp, mutrecnum = 0;
  int64_t tot_mutnum = 0, tot_basnum = 0;
  SeqIO *sifp, *sofp;
  SeqFastq *sqbufp;
  SeqCodec *codecp = NULL;
  BasQualFreq_t *bqfp;
  DiffStr *dfsp = NULL;
  ErrMsg *errmsgp=0;
  
  ERRMSG_CREATE(errmsgp);

  if (argc < 6) {
    fprintf(stderr, "usage: %s <base quality file (in)> <seed> "\
	    "<modify bases [y/n]> <FASTQ file (in)> <FASTQ file (out)>\n", argv[0]);
    exit(EXIT_FAILURE);
  }

  filnam_basq = argv[1];
  rand_seed = atoi(argv[2]);
  is_modify = (toupper(argv[3][0]) == 'Y')? 1: 0;
  filnam_fastq_in = argv[4];
  filnam_fastq_out = argv[5];

  RANSEED(rand_seed);

  if (!(sqbufp = seqFastqCreate(0, SEQTYP_FASTQ)))
    ERRMSGNO(errmsgp, ERRCODE_NOMEM);

  if ((is_modify)) {
    if (!(codecp = seqCodecCreate()))
      ERRMSGNO(errmsgp, ERRCODE_NOMEM);

    if (!(dfsp = diffStrCreate(0)))
      ERRMSGNO(errmsgp, ERRCODE_NOMEM);
  }

  printf("\nReading base qualities from file %s...\n", filnam_basq);
  bqfp = basQualFreqRead(&errcode, filnam_basq);
  if ((errcode))
    ERRMSGNO(errmsgp, errcode);

  printf("\nCalculate sums ...\n");
  if ((errcode = basQualFreqSum(bqfp)))
    ERRMSGNO(errmsgp, errcode);
  
  rlen_simulated = basQualFreqGetData(bqfp, NULL, &nqual, &qmin, NULL, NULL);
  printf("Simulated read length = %u\n", (unsigned int) rlen_simulated);
  printf("Minimum quality value = %i\n", (int) qmin);
  printf("Maximum quality value = %i\n", (int) qmin + nqual);

  if (rlen_simulated > INT_MAX)
    ERRMSG(errmsgp, "reads too long for simulation", ERRCODE_OVERFLOW);

  /* allocate helper arrays */
  ECALLOCP(rlen_simulated, mutbasp);
  if (mutbasp == NULL)
    ERRMSGNO(errmsgp, ERRCODE_NOMEM);

  ECALLOCP(rlen_simulated, mutposp);
  if (mutposp == NULL)
    ERRMSGNO(errmsgp, ERRCODE_NOMEM);
  
  printf("Open FASTQ file for input ...\n");
  sifp = seqIOopen(&errcode, filnam_fastq_in, SEQIO_READ, 0);
  if (errcode) 
    ERRMSGNO(errmsgp, errcode);

  printf("Open FASTQ file for output ...\n");
  sofp = seqIOopen(&errcode, filnam_fastq_out, SEQIO_WRITE_FASTQ, 0);
  if (errcode) 
    ERRMSGNO(errmsgp, errcode);

  while(!seqIOstatus(sifp) && !seqIOstatus(sofp)) {
    //printf("Reading sequence %i ...\n", sctr);
    if ((errcode = seqFastqRead(sqbufp, sifp)))
      break;
    qualp = seqFastqGetQualityFactors(sqbufp, &rlen, NULL);

    if (rlen > rlen_simulated)
      ERRMSG(errmsgp, "read length greater than simulated", ERRCODE_ASSERT);
      
    if ((errcode = basQualFreqSimulate(qualp, rlen, bqfp)))
      ERRMSGNO(errmsgp, errcode);
    
    tot_basnum += rlen;

    if ((is_modify)) {
      int dlen, buflen, nchar=0;
      mutrecnum = 0;
      if ((errcode = mutateNtSeq(sqbufp, &mutrecnum, mutbasp, mutposp, codecp)))
	ERRMSGNO(errmsgp, errcode);
      tot_mutnum += mutrecnum;

      if ((errcode = diffStrGenerateFromMismatches(&dlen, NULL, mutposp, mutrecnum, (int) rlen)))
	ERRMSGNO(errmsgp, errcode);

      if (dlen >= dfsp->n_alloc &&
	  (errcode = diffStrRealloc(dfsp, dlen)))
	ERRMSGNO(errmsgp, errcode);

      diffStrGenerateFromMismatches(NULL, dfsp->dstrp, mutposp, mutrecnum, (int) rlen);

      strncpy(nambuf, seqFastqGetSeqName(sqbufp), NAMBUF_MAXLEN);
      nambuf[NAMBUF_MAXLEN-1] = '\0';
      buflen = (int) strlen(nambuf);
      if (buflen < 1 || buflen*NAMSIZ_PER_MUTREC > NAMBUF_MAXLEN-1)
	ERRMSG(errmsgp, "Name buffer overflow", ERRCODE_ASSERT);

      nambuf[buflen++] = ' ';
      nambuf[buflen] = '\0';
      if ((errcode = diffStrPrintfStr(nambuf + buflen, &nchar, dfsp->dstrp, DIFFSTRFORM_PLAIN, 0, 0, 0)))
	ERRMSGNO(errmsgp, errcode);
      nambuf[NAMBUF_MAXLEN-1] = '\0';
      
      if ((errcode = seqFastqSetAscii(sqbufp, nambuf, NULL, NULL, NULL)))
	ERRMSGNO(errmsgp, errcode);
    }
    
    if ((errcode = seqFastqWrite(sofp, sqbufp, 0)))
      ERRMSGNO(errmsgp, errcode);
  }
  if (seqIOstatus(sofp))
    ERRMSGNO(errmsgp, seqIOstatus(sofp));
  seqIOclose(sofp);

  if (seqIOstatus(sifp) && 
      seqIOstatus(sifp) != ERRCODE_EOF) 
    ERRMSGNO(errmsgp, seqIOstatus(sifp));
  seqIOclose(sifp);

  printf("# simqual: introduced %lli mutations in %lli bases (%Lg%%)\n", 
	 (long long int) tot_mutnum, (long long int) tot_basnum,
	 (((long double) tot_mutnum)/tot_basnum)*100);

  free(mutbasp);
  free(mutposp);

  basQualFreqDelete(bqfp);
  diffStrDelete(dfsp);
  seqCodecDelete(codecp);
  seqFastqDelete(sqbufp);

  ERRMSG_END(errmsgp);
  exit(errcode);
}