int main(int argc, char **argv) { int status; ESL_RANDOMNESS *r = esl_randomness_CreateTimeseeded(); ESL_ALPHABET *abc = esl_alphabet_Create(eslAMINO); ESL_SCOREMATRIX *S = NULL; ESL_DSQ *x = NULL; /* iid query */ ESL_DSQ *y = NULL; /* iid target */ double lambda; double bg[20]; /* iid background probabilities */ int L; /* query length */ int M; /* target length */ int nseq; /* number of target seqs to simulate */ int i; int gop; int gex; char *mxfile = "PMX"; int raw_sc; /* Configuration */ L = 400; /* query length */ M = 400; /* target length */ nseq = 50000; gop = -11; gex = -1; lambda = 0.3207; ESL_ALLOC(x, sizeof(ESL_DSQ) * (L+2)); ESL_ALLOC(y, sizeof(ESL_DSQ) * (M+2)); /* Input an amino acid score matrix from a file. */ if (mxfile != NULL) { ESL_FILEPARSER *efp = NULL; if ( esl_fileparser_Open(mxfile, &efp) != eslOK) esl_fatal("failed to open score file %s", mxfile); if ( esl_sco_Read(efp, abc, &S) != eslOK) esl_fatal("failed to read matrix from %s", mxfile); esl_fileparser_Close(efp); } else { /* default = BLOSUM62 */ S = esl_scorematrix_Create(abc); esl_scorematrix_SetBLOSUM62(S); } esl_composition_BL62(bg); esl_rsq_xIID(r, bg, 20, L, x); for (i = 0; i < nseq; i++) { esl_rsq_xIID(r, bg, 20, M, y); esl_swat_Score(x, L, y, M, S, gop, gex, &raw_sc); printf("%d\n", raw_sc); } free(x); free(y); esl_scorematrix_Destroy(S); esl_alphabet_Destroy(abc); esl_randomness_Destroy(r); exit(0); ERROR: exit(status); }
int main(int argc, char **argv) { ESL_GETOPTS *go = p7_CreateDefaultApp(options, 2, argc, argv, banner, usage); ESL_ALPHABET *abc = esl_alphabet_Create(eslAMINO); char *qfile = esl_opt_GetArg(go, 1); char *tfile = esl_opt_GetArg(go, 2); ESL_SQFILE *qfp = NULL; ESL_SQFILE *tfp = NULL; ESL_SQ *qsq = esl_sq_CreateDigital(abc); ESL_SQ *tsq = esl_sq_CreateDigital(abc); ESL_SCOREMATRIX *S = esl_scorematrix_Create(abc); ESL_DMATRIX *Q = NULL; P7_BG *bg = p7_bg_Create(abc); P7_HMM *hmm = NULL; P7_PROFILE *gm = NULL; P7_REFMX *vit = p7_refmx_Create(200, 400); /* will grow as needed */ double *fa = malloc(sizeof(double) * abc->K); double popen = 0.02; double pextend = 0.4; double lambda; float vsc; float nullsc; int status; esl_composition_BL62(fa); esl_vec_D2F(fa, abc->K, bg->f); esl_scorematrix_Set("BLOSUM62", S); esl_scorematrix_ProbifyGivenBG(S, fa, fa, &lambda, &Q); esl_scorematrix_JointToConditionalOnQuery(abc, Q); if (esl_sqfile_OpenDigital(abc, qfile, eslSQFILE_UNKNOWN, NULL, &qfp) != eslOK) esl_fatal("failed to open %s", qfile); if (esl_sqio_Read(qfp, qsq) != eslOK) esl_fatal("failed to read query seq"); p7_Seqmodel(abc, qsq->dsq, qsq->n, qsq->name, Q, bg->f, popen, pextend, &hmm); p7_hmm_SetComposition(hmm); p7_hmm_SetConsensus(hmm, qsq); gm = p7_profile_Create(hmm->M, abc); p7_profile_ConfigUnilocal(gm, hmm, bg, 400); if (esl_sqfile_OpenDigital(abc, tfile, eslSQFILE_UNKNOWN, NULL, &tfp) != eslOK) esl_fatal("failed to open %s", tfile); while ((status = esl_sqio_Read(tfp, tsq)) == eslOK) { p7_bg_SetLength (bg, tsq->n); p7_profile_SetLength(gm, tsq->n); p7_ReferenceViterbi(tsq->dsq, tsq->n, gm, vit, NULL, &vsc); p7_bg_NullOne(bg, tsq->dsq, tsq->n, &nullsc); printf("%.4f %-25s %-25s\n", (vsc - nullsc) / eslCONST_LOG2, tsq->name, gm->name); esl_sq_Reuse(tsq); p7_refmx_Reuse(vit); } p7_refmx_Destroy(vit); p7_profile_Destroy(gm); p7_hmm_Destroy(hmm); p7_bg_Destroy(bg); esl_dmatrix_Destroy(Q); esl_scorematrix_Destroy(S); free(fa); esl_sq_Destroy(qsq); esl_sq_Destroy(tsq); esl_sqfile_Close(qfp); esl_sqfile_Close(tfp); esl_alphabet_Destroy(abc); esl_getopts_Destroy(go); return 0; }