Packages/mafft/src/mafft-7.487-with-extensions/core/partSalignmm.c
starsareintherose eeb4358381 add mafft
2021-08-10 22:21:03 +08:00

2119 lines
50 KiB
C

#include "mltaln.h"
#include "dp.h"
#define MACHIGAI 0
#define OUTGAP0TRY 1
#define DEBUG 0
#define XXXXXXX 0
#define USE_PENALTY_EX 0
#define FASTMATCHCALC 1
#if 0
static void st_OpeningGapCount( double *ogcp, int clus, char **seq, double *eff, int len )
{
int i, j, gc, gb;
double feff;
for( i=0; i<len; i++ ) ogcp[i] = 0.0;
for( j=0; j<clus; j++ )
{
feff = (double)eff[j];
gc = 0;
for( i=0; i<len; i++ )
{
gb = gc;
gc = ( seq[j][i] == '-' );
{
if( !gb * gc ) ogcp[i] += feff;
}
}
}
}
static void st_FinalGapCount( double *fgcp, int clus, char **seq, double *eff, int len )
{
int i, j, gc, gb;
double feff;
for( i=0; i<len; i++ ) fgcp[i] = 0.0;
for( j=0; j<clus; j++ )
{
feff = (double)eff[j];
gc = ( seq[j][0] == '-' );
for( i=1; i<len+1; i++ )
{
gb = gc;
gc = ( seq[j][i] == '-' );
{
if( gb * !gc ) fgcp[i-1] += feff;
}
}
}
}
#endif
static TLS int impalloclen = 0;
static TLS double **impmtx = NULL;
double part_imp_match_out_sc( int i1, int j1 )
{
// fprintf( stderr, "impalloclen = %d\n", impalloclen );
// fprintf( stderr, "i1,j1=%d,%d -> impmtx=%f\n", i1, j1, impmtx[i1][j1] );
return( impmtx[i1][j1] );
#if 0
if( i1 == l1 || j1 == l2 ) return( 0.0 );
return( impmtx[i1+start1][j1+start2] );
#endif
}
static void part_imp_match_out_vead_gapmap( double *imp, int i1, int lgth2, int start2, int *gapmap2 )
{
#if FASTMACHCALC
double *pt = imp;
int *gapmappt = gapmap2;
while( lgth2-- )
*pt++ += impmtx[i1][start2+*gapmappt++];
#else
int j;
for( j=0; j<lgth2; j++ )
{
imp[j] += impmtx[i1][start2+gapmap2[j]];
}
#endif
}
static void part_imp_match_out_vead_tate_gapmap( double *imp, int j1, int lgth1, int start1, int *gapmap1 )
{
#if FASTMACHCALC
double *pt = imp;
int *gapmappt = gapmap1;
while( lgth1-- )
*pt++ = impmtx[start1+*gapmappt++][j1];
#else
int i;
for( i=0; i<lgth1; i++ )
{
imp[i] += impmtx[start1+gapmap1[i]][j1];
}
#endif
}
#if 1
void part_imp_match_init_strict( double *imp, int clus1, int clus2, int lgth1, int lgth2, char **seq1, char **seq2, double *eff1, double *eff2, double *eff1_kozo, double *eff2_kozo, LocalHom ***localhom, char *swaplist, int forscore, int *orinum1, int *orinum2 )
{
// int i, j, k1, k2, tmpint, start1, start2, end1, end2;
// double effij;
// double effij_kozo;
// double effijx;
// char *pt, *pt1, *pt2;
// static TLS char *nocount1 = NULL;
// static TLS char *nocount2 = NULL;
// LocalHom *tmpptr;
if( seq1 == NULL )
{
if( impmtx ) FreeFloatMtx( impmtx );
impmtx = NULL;
// if( nocount1 ) free( nocount1 );
// nocount1 = NULL;
// if( nocount2 ) free( nocount2 );
// nocount2 = NULL;
return;
}
if( impalloclen < lgth1 + 2 || impalloclen < lgth2 + 2 )
{
if( impmtx ) FreeFloatMtx( impmtx );
// if( nocount1 ) free( nocount1 );
// if( nocount2 ) free( nocount2 );
impalloclen = MAX( lgth1, lgth2 ) + 2;
impmtx = AllocateFloatMtx( impalloclen, impalloclen );
// nocount1 = AllocateCharVec( impalloclen );
// nocount2 = AllocateCharVec( impalloclen );
}
fillimp( impmtx, imp, clus1, clus2, lgth1, lgth2, seq1, seq2, eff1, eff2, eff1_kozo, eff2_kozo, localhom, swaplist, forscore, orinum1, orinum2 );
}
#else
#endif
void part_imp_rna( int nseq1, int nseq2, char **seq1, char **seq2, double *eff1, double *eff2, RNApair ***grouprna1, RNApair ***grouprna2, int *gapmap1, int *gapmap2, RNApair *additionalpair )
{
foldrna( nseq1, nseq2, seq1, seq2, eff1, eff2, grouprna1, grouprna2, impmtx, gapmap1, gapmap2, additionalpair );
}
static void match_calc( double *match, double **cpmx1, double **cpmx2, int i1, int lgth2, double **doublework, int **intwork, int initialize )
{
#if FASTMATCHCALC
int j, l;
// double scarr[26];
double **cpmxpd = doublework;
int **cpmxpdn = intwork;
double *matchpt, *cpmxpdpt, **cpmxpdptpt;
int *cpmxpdnpt, **cpmxpdnptpt;
double *scarr;
scarr = calloc( nalphabets, sizeof( double ) );
if( initialize )
{
int count = 0;
for( j=0; j<lgth2; j++ )
{
count = 0;
for( l=0; l<nalphabets; l++ )
{
if( cpmx2[l][j] )
{
cpmxpd[j][count] = cpmx2[l][j];
cpmxpdn[j][count] = l;
count++;
}
}
cpmxpdn[j][count] = -1;
}
}
{
for( l=0; l<nalphabets; l++ )
{
scarr[l] = 0.0;
for( j=0; j<nalphabets; j++ )
scarr[l] += n_dis_consweight_multi[j][l] * cpmx1[j][i1];
// scarr[l] += n_dis[j][l] * cpmx1[j][i1];
}
matchpt = match;
cpmxpdnptpt = cpmxpdn;
cpmxpdptpt = cpmxpd;
while( lgth2-- )
{
*matchpt = 0.0;
cpmxpdnpt = *cpmxpdnptpt++;
cpmxpdpt = *cpmxpdptpt++;
while( *cpmxpdnpt>-1 )
*matchpt += scarr[*cpmxpdnpt++] * *cpmxpdpt++;
matchpt++;
}
}
free( scarr );
#else
int j, k, l;
// double scarr[26];
double **cpmxpd = doublework;
int **cpmxpdn = intwork;
double *scarr;
scarr = calloc( nalphabets, sizeof( double ) );
// simple
if( initialize )
{
int count = 0;
for( j=0; j<lgth2; j++ )
{
count = 0;
for( l=0; l<nalphabets; l++ )
{
if( cpmx2[l][j] )
{
cpmxpd[count][j] = cpmx2[l][j];
cpmxpdn[count][j] = l;
count++;
}
}
cpmxpdn[count][j] = -1;
}
}
for( l=0; l<nalphabets; l++ )
{
scarr[l] = 0.0;
for( k=0; k<nalphabets; k++ )
scarr[l] += n_dis_consweight_multi[k][l] * cpmx1[k][i1];
// scarr[l] += n_dis[k][l] * cpmx1[k][i1];
}
for( j=0; j<lgth2; j++ )
{
match[j] = 0.0;
for( k=0; cpmxpdn[k][j]>-1; k++ )
match[j] += scarr[cpmxpdn[k][j]] * cpmxpd[k][j];
}
#endif
}
static void fillzero( double *s, int l )
{
while( l-- ) *s++ = 0.0;
}
static void match_calc_del( int **which, double ***matrices, double *match, int n1, char **seq1, double *eff1, int n2, char **seq2, double *eff2, int i1, int lgth2, int mid, int nmask, int *mask1, int *mask2 )
{
// osoi!
int i, j, k, m;
int c1, c2;
// fprintf( stderr, "\nmatch_calc_dynamicmtx... %d", i1 );
// fprintf( stderr, "\nseq1[0]=%s\n", seq1[0] );
// fprintf( stderr, "\nseq2[0]=%s\n", seq2[0] );
// for( i=0; i<n1; i++ ) for( j=0; j<n2; j++ )
// {
// if( flip ) reporterr( "in match_calc_slow, which[%d][%d] = %d\n", j, i, which[j][i] );
// else reporterr( "in match_calc_slow, which[%d][%d] = %d\n", i, j, which[i][j] );
// }
for( k=0; k<lgth2; k++ )
{
for( m=0; m<nmask; m++ )
{
i = mask1[m];
j = mask2[m];
// reporterr( "Deleting %d-%d (c=%d)\n", i, j, mid );
// if( k==0 ) fprintf( stderr, "pairoffset[%d][%d] = %f\n", i, j, po );
c1 = amino_n[(int)seq1[i][i1]];
c2 = amino_n[(int)seq2[j][k]];
// reporterr( "k=%d, c1=%d, c2=%d, seq1[i][i1]=%c, seq2[%d][%d]=%c\n", k, c1, c2, seq1[i][i1], j, k, seq2[j][k] );
if( seq1[i][i1] == '-' || seq2[j][k] == '-' ) continue;
if( c1 < 0 || c2 < 0 ) continue;
// fprintf( stderr, "c1=%d, c2=%d\n", c1, c2 );
// fprintf( stderr, "match[k] = %f -> ", match[k], mid );
match[k] -= matrices[mid][c1][c2] * eff1[i] * eff2[j];
// fprintf( stderr, "match[k] = %f (mid=%d)\n", match[k], mid );
}
}
// fprintf( stderr, "done\n" );
return;
}
static void match_calc_add( double **scoreingmtx, double *match, double **cpmx1, double **cpmx2, int i1, int lgth2, double **doublework, int **intwork, int initialize )
{
#if FASTMATCHCALC
// fprintf( stderr, "\nmatch_calc... %d", i1 );
int j, l;
// double scarr[26];
double **cpmxpd = doublework;
int **cpmxpdn = intwork;
double *matchpt, *cpmxpdpt, **cpmxpdptpt;
int *cpmxpdnpt, **cpmxpdnptpt;
double *scarr;
scarr = calloc( nalphabets, sizeof( double ) );
if( initialize )
{
int count = 0;
for( j=0; j<lgth2; j++ )
{
count = 0;
for( l=0; l<nalphabets; l++ )
{
if( cpmx2[l][j] )
{
cpmxpd[j][count] = cpmx2[l][j];
cpmxpdn[j][count] = l;
count++;
}
}
cpmxpdn[j][count] = -1;
}
}
{
for( l=0; l<nalphabets; l++ )
{
scarr[l] = 0.0;
for( j=0; j<nalphabets; j++ )
// scarr[l] += n_dis[j][l] * cpmx1[j][i1];
// scarr[l] += n_dis_consweight_multi[j][l] * cpmx1[j][i1];
scarr[l] += scoreingmtx[j][l] * cpmx1[j][i1];
}
matchpt = match;
cpmxpdnptpt = cpmxpdn;
cpmxpdptpt = cpmxpd;
while( lgth2-- )
{
// *matchpt = 0.0;
cpmxpdnpt = *cpmxpdnptpt++;
cpmxpdpt = *cpmxpdptpt++;
while( *cpmxpdnpt>-1 )
*matchpt += scarr[*cpmxpdnpt++] * *cpmxpdpt++;
matchpt++;
}
}
free( scarr );
// fprintf( stderr, "done\n" );
#else
int j, k, l;
// double scarr[26];
double **cpmxpd = doublework;
int **cpmxpdn = intwork;
double *scarr;
scarr = calloc( nalphabets, sizeof( double ) );
// simple
if( initialize )
{
int count = 0;
for( j=0; j<lgth2; j++ )
{
count = 0;
for( l=0; l<nalphabets; l++ )
{
if( cpmx2[l][j] )
{
cpmxpd[count][j] = cpmx2[l][j];
cpmxpdn[count][j] = l;
count++;
}
}
cpmxpdn[count][j] = -1;
}
}
for( l=0; l<nalphabets; l++ )
{
scarr[l] = 0.0;
for( k=0; k<nalphabets; k++ )
// scarr[l] += n_dis[k][l] * cpmx1[k][i1];
// scarr[l] += n_dis_consweight_multi[k][l] * cpmx1[k][i1];
scarr[l] += scoreingmtx[k][l] * cpmx1[k][i1];
}
for( j=0; j<lgth2; j++ )
{
match[j] = 0.0;
for( k=0; cpmxpdn[k][j]>-1; k++ )
match[j] += scarr[cpmxpdn[k][j]] * cpmxpd[k][j];
}
free( scarr );
#endif
}
static void Atracking_localhom( double *impwmpt, double *lasthorizontalw, double *lastverticalw,
char **seq1, char **seq2,
char **mseq1, char **mseq2,
int **ijp, int icyc, int jcyc,
int start1, int end1, int start2, int end2,
int *gapmap1, int *gapmap2,
int *warpis, int *warpjs, int warpbase )
{
int i, j, l, iin, jin, ifi, jfi, lgth1, lgth2, k, limk;
// char gap[] = "-";
char *gap;
double wm;
gap = newgapstr;
lgth1 = strlen( seq1[0] );
lgth2 = strlen( seq2[0] );
#if 0
for( i=0; i<lgth1; i++ )
{
fprintf( stderr, "lastverticalw[%d] = %f\n", i, lastverticalw[i] );
}
#endif
if( outgap == 1 )
;
else
{
wm = lastverticalw[0];
for( i=0; i<lgth1; i++ )
{
if( lastverticalw[i] >= wm )
{
wm = lastverticalw[i];
iin = i; jin = lgth2-1;
ijp[lgth1][lgth2] = +( lgth1 - i );
}
}
for( j=0; j<lgth2; j++ )
{
if( lasthorizontalw[j] >= wm )
{
wm = lasthorizontalw[j];
iin = lgth1-1; jin = j;
ijp[lgth1][lgth2] = -( lgth2 - j );
}
}
}
for( i=0; i<lgth1+1; i++ )
{
ijp[i][0] = i + 1;
}
for( j=0; j<lgth2+1; j++ )
{
ijp[0][j] = -( j + 1 );
}
for( i=0; i<icyc; i++ )
{
mseq1[i] += lgth1+lgth2;
*mseq1[i] = 0;
}
for( j=0; j<jcyc; j++ )
{
mseq2[j] += lgth1+lgth2;
*mseq2[j] = 0;
}
iin = lgth1; jin = lgth2;
*impwmpt = 0.0;
limk = lgth1+lgth2+1;
for( k=0; k<limk; k++ )
{
if( ijp[iin][jin] >= warpbase )
{
ifi = warpis[ijp[iin][jin]-warpbase];
jfi = warpjs[ijp[iin][jin]-warpbase];
}
else if( ijp[iin][jin] < 0 )
{
ifi = iin-1; jfi = jin+ijp[iin][jin];
}
else if( ijp[iin][jin] > 0 )
{
ifi = iin-ijp[iin][jin]; jfi = jin-1;
}
else
{
ifi = iin-1; jfi = jin-1;
}
if( ifi == -warpbase && jfi == -warpbase )
{
l = iin;
while( --l >= 0 )
{
for( i=0; i<icyc; i++ )
*--mseq1[i] = seq1[i][l];
for( j=0; j<jcyc; j++ )
*--mseq2[j] = *gap;
k++;
}
l= jin;
while( --l >= 0 )
{
for( i=0; i<icyc; i++ )
*--mseq1[i] = *gap;
for( j=0; j<jcyc; j++ )
*--mseq2[j] = seq2[j][l];
k++;
}
break;
}
else
{
l = iin - ifi;
while( --l )
{
for( i=0; i<icyc; i++ )
*--mseq1[i] = seq1[i][ifi+l];
for( j=0; j<jcyc; j++ )
*--mseq2[j] = *gap;
k++;
}
l= jin - jfi;
while( --l )
{
for( i=0; i<icyc; i++ )
*--mseq1[i] = *gap;
for( j=0; j<jcyc; j++ )
*--mseq2[j] = seq2[j][jfi+l];
k++;
}
}
if( iin != lgth1 && jin != lgth2 ) // ??
{
*impwmpt += (double)part_imp_match_out_sc( gapmap1[iin]+start1, gapmap2[jin]+start2 );
// fprintf( stderr, "impwm = %f (iin=%d, jin=%d) seq1=%c, seq2=%c\n", *impwmpt, iin, jin, seq1[0][iin], seq2[0][jin] );
}
if( iin <= 0 || jin <= 0 ) break;
for( i=0; i<icyc; i++ )
*--mseq1[i] = seq1[i][ifi];
for( j=0; j<jcyc; j++ )
*--mseq2[j] = seq2[j][jfi];
k++;
iin = ifi; jin = jfi;
}
}
static double Atracking( double *lasthorizontalw, double *lastverticalw,
char **seq1, char **seq2,
char **mseq1, char **mseq2,
int **ijp, int icyc, int jcyc,
int *warpis, int *warpjs, int warpbase )
{
int i, j, l, iin, jin, ifi, jfi, lgth1, lgth2, k, lastk, limk;
// char gap[] = "-";
char *gap;
gap = newgapstr;
double wm = 0.0;
lgth1 = strlen( seq1[0] );
lgth2 = strlen( seq2[0] );
#if 0
for( i=0; i<lgth1; i++ )
{
fprintf( stderr, "lastverticalw[%d] = %f\n", i, lastverticalw[i] );
}
#endif
if( outgap == 1 )
;
else
{
wm = lastverticalw[0];
for( i=0; i<lgth1; i++ )
{
if( lastverticalw[i] >= wm )
{
wm = lastverticalw[i];
iin = i; jin = lgth2-1;
ijp[lgth1][lgth2] = +( lgth1 - i );
}
}
for( j=0; j<lgth2; j++ )
{
if( lasthorizontalw[j] >= wm )
{
wm = lasthorizontalw[j];
iin = lgth1-1; jin = j;
ijp[lgth1][lgth2] = -( lgth2 - j );
}
}
}
for( i=0; i<lgth1+1; i++ )
{
ijp[i][0] = i + 1;
}
for( j=0; j<lgth2+1; j++ )
{
ijp[0][j] = -( j + 1 );
}
for( i=0; i<icyc; i++ )
{
mseq1[i] += lgth1+lgth2;
*mseq1[i] = 0;
}
for( j=0; j<jcyc; j++ )
{
mseq2[j] += lgth1+lgth2;
*mseq2[j] = 0;
}
iin = lgth1; jin = lgth2;
lastk = lgth1+lgth2;
limk = lgth1+lgth2+1;
for( k=0; k<limk; k++ )
{
if( ijp[iin][jin] >= warpbase )
{
ifi = warpis[ijp[iin][jin]-warpbase];
jfi = warpjs[ijp[iin][jin]-warpbase];
}
else if( ijp[iin][jin] < 0 )
{
ifi = iin-1; jfi = jin+ijp[iin][jin];
}
else if( ijp[iin][jin] > 0 )
{
ifi = iin-ijp[iin][jin]; jfi = jin-1;
}
else
{
ifi = iin-1; jfi = jin-1;
}
if( ifi == -warpbase && jfi == -warpbase )
{
l = iin;
while( --l >= 0 )
{
for( i=0; i<icyc; i++ )
*--mseq1[i] = seq1[i][l];
for( j=0; j<jcyc; j++ )
*--mseq2[j] = *gap;
k++;
}
l= jin;
while( --l >= 0 )
{
for( i=0; i<icyc; i++ )
*--mseq1[i] = *gap;
for( j=0; j<jcyc; j++ )
*--mseq2[j] = seq2[j][l];
k++;
}
break;
}
else
{
l = iin - ifi;
while( --l )
{
for( i=0; i<icyc; i++ )
*--mseq1[i] = seq1[i][ifi+l];
for( j=0; j<jcyc; j++ )
*--mseq2[j] = *gap;
k++;
}
l= jin - jfi;
while( --l )
{
for( i=0; i<icyc; i++ )
*--mseq1[i] = *gap;
for( j=0; j<jcyc; j++ )
*--mseq2[j] = seq2[j][jfi+l];
k++;
}
}
if( iin <= 0 || jin <= 0 ) break;
for( i=0; i<icyc; i++ )
*--mseq1[i] = seq1[i][ifi];
for( j=0; j<jcyc; j++ )
*--mseq2[j] = seq2[j][jfi];
k++;
iin = ifi; jin = jfi;
}
return( 0.0 );
}
double partA__align( char **seq1, char **seq2, double *eff1, double *eff2, int icyc, int jcyc, int alloclen, int constraint, double *impmatch, int start1, int end1, int start2, int end2, int *gapmap1, int *gapmap2, char *sgap1, char *sgap2, char *egap1, char *egap2, int *chudanpt, int chudanref, int *chudanres )
/* score no keisan no sai motokaraaru gap no atukai ni mondai ga aru */
{
// int k;
register int i, j;
int lasti, lastj; /* outgap == 0 -> lgth1, outgap == 1 -> lgth1+1 */
int lgth1, lgth2;
int resultlen;
double wm = 0.0; /* int ?????? */
double g;
double *currentw, *previousw;
#if 1
double *wtmp;
int *ijppt;
double *mjpt, *prept, *curpt;
int *mpjpt;
#endif
static TLS double mi, *m;
static TLS int **ijp;
static TLS int mpi, *mp;
static TLS double *w1, *w2;
static TLS double *match;
static TLS double *initverticalw; /* kufuu sureba iranai */
static TLS double *lastverticalw; /* kufuu sureba iranai */
static TLS char **mseq1;
static TLS char **mseq2;
static TLS char **mseq;
static TLS double *ogcp1;
static TLS double *ogcp2;
static TLS double *fgcp1;
static TLS double *fgcp2;
static TLS double **cpmx1;
static TLS double **cpmx2;
static TLS double *gapfreq1;
static TLS double *gapfreq2;
static TLS int **intwork;
static TLS double **doublework;
static TLS int orlgth1 = 0, orlgth2 = 0;
double fpenalty = (double)penalty;
double fpenalty_shift = (double)penalty_shift;
#if USE_PENALTY_EX
double fpenalty_ex = (double)penalty_ex;
#endif
double *fgcp2pt;
double *ogcp2pt;
double fgcp1va;
double ogcp1va;
double *gf2pt;
double *gf2ptpre;
double gf1va;
double gf1vapre;
double headgapfreq1;
double headgapfreq2;
int *warpis = NULL;
int *warpjs = NULL;
int *warpi = NULL;
int *warpj = NULL;
int *prevwarpi = NULL;
int *prevwarpj = NULL;
double *wmrecords = NULL;
double *prevwmrecords = NULL;
int warpn = 0;
int warpbase;
double curm = 0.0;
double *wmrecordspt, *wmrecords1pt, *prevwmrecordspt;
int *warpipt, *warpjpt;
if( seq1 == NULL )
{
if( orlgth1 )
{
// fprintf( stderr, "## Freeing local arrays in A__align\n" );
orlgth1 = 0;
orlgth2 = 0;
part_imp_match_init_strict( NULL, 0, 0, 0, 0, NULL, NULL, NULL, NULL, NULL, NULL, NULL, NULL, 0, NULL, NULL );
free( mseq1 );
free( mseq2 );
FreeFloatVec( w1 );
FreeFloatVec( w2 );
FreeFloatVec( match );
FreeFloatVec( initverticalw );
FreeFloatVec( lastverticalw );
FreeFloatVec( m );
FreeIntVec( mp );
FreeCharMtx( mseq );
FreeFloatVec( ogcp1 );
FreeFloatVec( ogcp2 );
FreeFloatVec( fgcp1 );
FreeFloatVec( fgcp2 );
FreeFloatMtx( cpmx1 );
FreeFloatMtx( cpmx2 );
FreeFloatVec( gapfreq1 );
FreeFloatVec( gapfreq2 );
FreeFloatMtx( doublework );
FreeIntMtx( intwork );
}
else
{
// fprintf( stderr, "## Not allocated\n" );
}
return( 0.0 );
}
// fprintf( stderr, "IN partA__align\n" );
lgth1 = strlen( seq1[0] );
lgth2 = strlen( seq2[0] );
#if 1
// if( lgth1 == 0 ) fprintf( stderr, "WARNING: lgth1=0 in partA__align\n" );
// if( lgth2 == 0 ) fprintf( stderr, "WARNING: lgth2=0 in partA__align\n" );
if( lgth1 == 0 && lgth2 == 0 )
return( 0.0 );
if( lgth1 == 0 )
{
for( i=0; i<icyc; i++ )
{
j = lgth2;
seq1[i][j] = 0;
while( j ) seq1[i][--j] = *newgapstr;
// fprintf( stderr, "seq1[i] = %s\n", seq1[i] );
}
return( 0.0 );
}
if( lgth2 == 0 )
{
for( i=0; i<jcyc; i++ )
{
j = lgth1;
seq2[i][j] = 0;
while( j ) seq2[i][--j] = *newgapstr;
// fprintf( stderr, "seq2[i] = %s\n", seq2[i] );
}
return( 0.0 );
}
#endif
warpbase = lgth1 + lgth2;
warpis = NULL;
warpjs = NULL;
warpn = 0;
if( trywarp )
{
if( outgap == 0 )
{
fprintf( stderr, "At present, outgap must be 1.\n" );
exit( 1 );
}
wmrecords = AllocateFloatVec( lgth2+1 );
warpi = AllocateIntVec( lgth2+1 );
warpj = AllocateIntVec( lgth2+1 );
prevwmrecords = AllocateFloatVec( lgth2+1 );
prevwarpi = AllocateIntVec( lgth2+1 );
prevwarpj = AllocateIntVec( lgth2+1 );
for( i=0; i<lgth2+1; i++ ) wmrecords[i] = 0.0;
for( i=0; i<lgth2+1; i++ ) prevwmrecords[i] = 0.0;
for( i=0; i<lgth2+1; i++ ) prevwarpi[i] = -warpbase;
for( i=0; i<lgth2+1; i++ ) prevwarpj[i] = -warpbase;
for( i=0; i<lgth2+1; i++ ) warpi[i] = -warpbase;
for( i=0; i<lgth2+1; i++ ) warpj[i] = -warpbase;
}
#if 0
fprintf( stderr, "eff in SA+++align\n" );
for( i=0; i<icyc; i++ ) fprintf( stderr, "eff1[%d] = %f\n", i, eff1[i] );
#endif
if( orlgth1 == 0 )
{
mseq1 = AllocateCharMtx( njob, 0 );
mseq2 = AllocateCharMtx( njob, 0 );
}
if( lgth1 > orlgth1 || lgth2 > orlgth2 )
{
int ll1, ll2;
if( orlgth1 > 0 && orlgth2 > 0 )
{
FreeFloatVec( w1 );
FreeFloatVec( w2 );
FreeFloatVec( match );
FreeFloatVec( initverticalw );
FreeFloatVec( lastverticalw );
FreeFloatVec( m );
FreeIntVec( mp );
FreeCharMtx( mseq );
FreeFloatVec( ogcp1 );
FreeFloatVec( ogcp2 );
FreeFloatVec( fgcp1 );
FreeFloatVec( fgcp2 );
FreeFloatMtx( cpmx1 );
FreeFloatMtx( cpmx2 );
FreeFloatVec( gapfreq1 );
FreeFloatVec( gapfreq2 );
FreeFloatMtx( doublework );
FreeIntMtx( intwork );
}
ll1 = MAX( (int)(1.3*lgth1), orlgth1 ) + 100;
ll2 = MAX( (int)(1.3*lgth2), orlgth2 ) + 100;
#if DEBUG
fprintf( stderr, "\ntrying to allocate (%d+%d)xn matrices ... ", ll1, ll2 );
#endif
w1 = AllocateFloatVec( ll2+2 );
w2 = AllocateFloatVec( ll2+2 );
match = AllocateFloatVec( ll2+2 );
initverticalw = AllocateFloatVec( ll1+2 );
lastverticalw = AllocateFloatVec( ll1+2 );
m = AllocateFloatVec( ll2+2 );
mp = AllocateIntVec( ll2+2 );
mseq = AllocateCharMtx( njob, ll1+ll2 );
ogcp1 = AllocateFloatVec( ll1+2 );
ogcp2 = AllocateFloatVec( ll2+2 );
fgcp1 = AllocateFloatVec( ll1+2 );
fgcp2 = AllocateFloatVec( ll2+2 );
cpmx1 = AllocateFloatMtx( nalphabets, ll1+2 );
cpmx2 = AllocateFloatMtx( nalphabets, ll2+2 );
gapfreq1 = AllocateFloatVec( ll1+2 );
gapfreq2 = AllocateFloatVec( ll2+2 );
#if FASTMATCHCALC
doublework = AllocateFloatMtx( MAX( ll1, ll2 )+2, nalphabets );
intwork = AllocateIntMtx( MAX( ll1, ll2 )+2, nalphabets );
#else
doublework = AllocateFloatMtx( nalphabets, MAX( ll1, ll2 )+2 );
intwork = AllocateIntMtx( nalphabets, MAX( ll1, ll2 )+2 );
#endif
#if DEBUG
fprintf( stderr, "succeeded\n" );
#endif
orlgth1 = ll1 - 100;
orlgth2 = ll2 - 100;
}
for( i=0; i<icyc; i++ ) mseq1[i] = mseq[i];
for( j=0; j<jcyc; j++ ) mseq2[j] = mseq[icyc+j];
if( orlgth1 > commonAlloc1 || orlgth2 > commonAlloc2 )
{
int ll1, ll2;
if( commonAlloc1 && commonAlloc2 )
{
FreeIntMtx( commonIP );
}
ll1 = MAX( orlgth1, commonAlloc1 );
ll2 = MAX( orlgth2, commonAlloc2 );
#if DEBUG
fprintf( stderr, "\n\ntrying to allocate %dx%d matrices ... ", ll1+1, ll2+1 );
#endif
commonIP = AllocateIntMtx( ll1+10, ll2+10 );
#if DEBUG
fprintf( stderr, "succeeded\n\n" );
#endif
commonAlloc1 = ll1;
commonAlloc2 = ll2;
}
ijp = commonIP;
cpmx_calc_new( seq1, cpmx1, eff1, lgth1, icyc );
cpmx_calc_new( seq2, cpmx2, eff2, lgth2, jcyc );
if( sgap1 )
{
new_OpeningGapCount( ogcp1, icyc, seq1, eff1, lgth1, sgap1 );
new_OpeningGapCount( ogcp2, jcyc, seq2, eff2, lgth2, sgap2 );
new_FinalGapCount( fgcp1, icyc, seq1, eff1, lgth1, egap1 );
new_FinalGapCount( fgcp2, jcyc, seq2, eff2, lgth2, egap2 );
outgapcount( &headgapfreq1, icyc, sgap1, eff1 );
outgapcount( &headgapfreq2, jcyc, sgap2, eff2 );
outgapcount( gapfreq1+lgth1, icyc, egap1, eff1 );
outgapcount( gapfreq2+lgth2, jcyc, egap2, eff2 );
}
else
{
st_OpeningGapCount( ogcp1, icyc, seq1, eff1, lgth1 );
st_OpeningGapCount( ogcp2, jcyc, seq2, eff2, lgth2 );
st_FinalGapCount( fgcp1, icyc, seq1, eff1, lgth1 );
st_FinalGapCount( fgcp2, jcyc, seq2, eff2, lgth2 );
headgapfreq1 = 0.0;
headgapfreq2 = 0.0;
gapfreq1[lgth1] = 0.0;
gapfreq2[lgth2] = 0.0;
}
if( legacygapcost == 0 )
{
gapcountf( gapfreq1, seq1, icyc, eff1, lgth1 );
gapcountf( gapfreq2, seq2, jcyc, eff2, lgth2 );
for( i=0; i<lgth1+1; i++ ) gapfreq1[i] = 1.0 - gapfreq1[i];
for( i=0; i<lgth2+1; i++ ) gapfreq2[i] = 1.0 - gapfreq2[i];
headgapfreq1 = 1.0 - headgapfreq1;
headgapfreq2 = 1.0 - headgapfreq2;
}
else
{
for( i=0; i<lgth1+1; i++ ) gapfreq1[i] = 1.0;
for( i=0; i<lgth2+1; i++ ) gapfreq2[i] = 1.0;
headgapfreq1 = 1.0;
headgapfreq2 = 1.0;
}
for( i=0; i<lgth1; i++ )
{
ogcp1[i] = 0.5 * ( 1.0 - ogcp1[i] ) * fpenalty * ( gapfreq1[i] );
fgcp1[i] = 0.5 * ( 1.0 - fgcp1[i] ) * fpenalty * ( gapfreq1[i] );
}
for( i=0; i<lgth2; i++ )
{
ogcp2[i] = 0.5 * ( 1.0 - ogcp2[i] ) * fpenalty * ( gapfreq2[i] );
fgcp2[i] = 0.5 * ( 1.0 - fgcp2[i] ) * fpenalty * ( gapfreq2[i] );
}
#if 0
for( i=0; i<lgth1; i++ )
fprintf( stderr, "ogcp1[%d]=%f\n", i, ogcp1[i] );
#endif
currentw = w1;
previousw = w2;
match_calc( initverticalw, cpmx2, cpmx1, 0, lgth1, doublework, intwork, 1 );
if( constraint )
part_imp_match_out_vead_tate_gapmap( initverticalw, gapmap2[0]+start2, lgth1, start1, gapmap1 );
match_calc( currentw, cpmx1, cpmx2, 0, lgth2, doublework, intwork, 1 );
if( constraint )
part_imp_match_out_vead_gapmap( currentw, gapmap1[0]+start1, lgth2, start2, gapmap2 );
#if 0 // -> tbfast.c
if( localhom )
imp_match_calc( currentw, icyc, jcyc, lgth1, lgth2, seq1, seq2, eff1, eff2, localhom, 1, 0 );
#endif
if( outgap == 1 )
{
for( i=1; i<lgth1+1; i++ )
{
// initverticalw[i] += ( ogcp1[0] + fgcp1[i-1] ) ;
initverticalw[i] += ( ogcp1[0] * headgapfreq2 + fgcp1[i-1] * gapfreq2[0] ) ;
#if USE_PENALTY_EX
tsuika hitsuyou
#endif
}
for( j=1; j<lgth2+1; j++ )
{
// currentw[j] += ( ogcp2[0] + fgcp2[j-1] ) ;
currentw[j] += ( ogcp2[0] * headgapfreq1 + fgcp2[j-1] * gapfreq1[0] ) ;
#if USE_PENALTY_EX
tsuika hitsuyou
#endif
}
}
#if OUTGAP0TRY
else
{
for( j=1; j<lgth2+1; j++ )
currentw[j] -= offset * j / 2.0;
for( i=1; i<lgth1+1; i++ )
initverticalw[i] -= offset * i / 2.0;
}
#endif
for( j=1; j<lgth2+1; ++j )
{
// m[j] = currentw[j-1] + ogcp1[1]; mp[j] = 0;
m[j] = currentw[j-1] + ogcp1[1] * gapfreq2[j-1]; mp[j] = 0;;
}
lastverticalw[0] = currentw[lgth2-1];
if( outgap ) lasti = lgth1+1; else lasti = lgth1;
lastj = lgth2+1;
#if XXXXXXX
fprintf( stderr, "currentw = \n" );
for( i=0; i<lgth1+1; i++ )
{
fprintf( stderr, "%5.2f ", currentw[i] );
}
fprintf( stderr, "\n" );
fprintf( stderr, "initverticalw = \n" );
for( i=0; i<lgth2+1; i++ )
{
fprintf( stderr, "%5.2f ", initverticalw[i] );
}
fprintf( stderr, "\n" );
fprintf( stderr, "fcgp\n" );
for( i=0; i<lgth1; i++ )
fprintf( stderr, "fgcp1[%d]=%f\n", i, ogcp1[i] );
for( i=0; i<lgth2; i++ )
fprintf( stderr, "fgcp2[%d]=%f\n", i, ogcp2[i] );
#endif
for( i=1; i<lasti; i++ )
{
#ifdef enablemultithread
// fprintf( stderr, "chudan = %d, %d\n", *chudanpt, chudanref );
if( chudanpt && *chudanpt != chudanref )
{
// fprintf( stderr, "\n\n## CHUUDAN!!! i\n" );
*chudanres = 1;
return( -1.0 );
}
#endif
wtmp = previousw;
previousw = currentw;
currentw = wtmp;
previousw[0] = initverticalw[i-1];
match_calc( currentw, cpmx1, cpmx2, i, lgth2, doublework, intwork, 0 );
#if 0
fprintf( stderr, "\n" );
fprintf( stderr, "i=%d\n", i );
fprintf( stderr, "currentw before imp = \n" );
for( j=0; j<lgth2; j++ )
{
fprintf( stderr, "%5.2f ", currentw[j] );
}
fprintf( stderr, "\n" );
#endif
if( constraint )
{
// fprintf( stderr, "Calling imp_match_calc (o) lgth = %d, i = %d\n", lgth1, i );
// imp_match_out_vead( currentw, i, lgth2 );
part_imp_match_out_vead_gapmap( currentw, gapmap1[i]+start1, lgth2, start2, gapmap2 );
}
#if 0
fprintf( stderr, "specificity = 0\n" );
fprintf( stderr, "i=%d\n", i );
fprintf( stderr, "currentw = \n" );
for( j=0; j<lgth2; j++ )
{
fprintf( stderr, "%5.2f ", currentw[j] );
}
fprintf( stderr, "\n" );
#endif
currentw[0] = initverticalw[i];
// mi = previousw[0] + ogcp2[1]; mpi = 0;
mi = previousw[0] + ogcp2[1] * gapfreq1[i-1]; mpi=0;
ijppt = ijp[i] + 1;
mjpt = m + 1;
prept = previousw;
curpt = currentw + 1;
mpjpt = mp + 1;
fgcp2pt = fgcp2;
ogcp2pt = ogcp2+1;
fgcp1va = fgcp1[i-1];
ogcp1va = ogcp1[i];
gf1va = gapfreq1[i];
gf1vapre = gapfreq1[i-1];
gf2pt = gapfreq2+1;
gf2ptpre = gapfreq2;
if( trywarp )
{
prevwmrecordspt = prevwmrecords;
wmrecordspt = wmrecords+1;
wmrecords1pt = wmrecords;
warpipt = warpi + 1;
warpjpt = warpj + 1;
}
for( j=1; j<lastj; j++ )
{
#ifdef xxxenablemultithread
// fprintf( stderr, "chudan = %d, %d\n", *chudanpt, chudanref );
if( chudanpt && *chudanpt != chudanref )
{
// fprintf( stderr, "\n\n## CHUUDAN!!! j\n" );
*chudanres = 1;
return( -1.0 );
}
#endif
wm = *prept;
*ijppt = 0;
#if 0
fprintf( stderr, "%5.0f->", wm );
#endif
// g = mi + *fgcp2pt * gapfreq1[i];
if( (g = mi + *fgcp2pt * gf1va) > wm )
{
wm = g;
*ijppt = -( j - mpi );
}
// g = *prept + *ogcp2pt * gapfreq1[i-1];
// if( (g = *prept + *ogcp2pt * gf1vapre) >= mi )
if( (g = *prept + *ogcp2pt * gf1vapre) > mi ) // 2018/Apr
{
mi = g;
mpi = j-1;
}
#if USE_PENALTY_EX
mi += fpenalty_ex;
#endif
// g = *mjpt + fgcp1va * gapfreq2[j];
if( (g = *mjpt + fgcp1va * *gf2pt) > wm )
{
wm = g;
*ijppt = +( i - *mpjpt );
}
// g = *prept + ogcp1va * gapfreq2[j-1];
// if( (g = *prept + ogcp1va * *gf2ptpre) >= *mjpt )
if( (g = *prept + ogcp1va * *gf2ptpre) > *mjpt ) // 2018/Apr
{
*mjpt = g;
*mpjpt = i-1;
}
#if USE_PENALTY_EX
m[j] += fpenalty_ex;
#endif
if( trywarp )
{
#if USE_PENALTY_EX
if( ( g=*prevwmrecordspt++ + fpenalty_shift + fpenalty_ex * ( i - prevwarpi[j-1] + j - prevwarpj[j-1] ) ) > wm ) // naka ha osokute kamawanai
#else
if( ( g=*prevwmrecordspt++ + fpenalty_shift ) > wm ) // naka ha osokute kamawanai
#endif
{
// fprintf( stderr, "WARP in partA__align\n" );
if( warpn && prevwarpi[j-1] == warpis[warpn-1] && prevwarpj[j-1] == warpjs[warpn-1] )
{
*ijppt = warpbase + warpn - 1;
}
else
{
*ijppt = warpbase + warpn;
warpis = realloc( warpis, sizeof(int) * ( warpn+1 ) );
warpjs = realloc( warpjs, sizeof(int) * ( warpn+1 ) );
warpis[warpn] = prevwarpi[j-1];
warpjs[warpn] = prevwarpj[j-1];
warpn++;
}
wm = g;
}
curm = *curpt + wm;
if( *wmrecords1pt > *wmrecordspt )
{
*wmrecordspt = *wmrecords1pt;
*warpipt = *(warpipt-1);
*warpjpt = *(warpjpt-1);
}
if( curm > *wmrecordspt )
{
*wmrecordspt = curm;
*warpipt = i;
*warpjpt = j;
}
wmrecordspt++;
wmrecords1pt++;
warpipt++;
warpjpt++;
}
#if 0
fprintf( stderr, "%5.0f ", wm );
#endif
*curpt += wm;
ijppt++;
mjpt++;
prept++;
mpjpt++;
curpt++;
fgcp2pt++;
ogcp2pt++;
gf2ptpre++;
gf2pt++;
}
lastverticalw[i] = currentw[lgth2-1];
if( trywarp )
{
fltncpy( prevwmrecords, wmrecords, lastj );
intncpy( prevwarpi, warpi, lastj );
intncpy( prevwarpj, warpj, lastj );
}
}
if( trywarp )
{
// fprintf( stderr, "wm = %f\n", wm );
// fprintf( stderr, "warpn = %d\n", warpn );
free( wmrecords );
free( prevwmrecords );
free( warpi );
free( warpj );
free( prevwarpi );
free( prevwarpj );
}
#if OUTGAP0TRY
if( !outgap )
{
for( j=1; j<lgth2+1; j++ )
currentw[j] -= offset * ( lgth2 - j ) / 2.0;
for( i=1; i<lgth1+1; i++ )
lastverticalw[i] -= offset * ( lgth1 - i / 2.0);
}
#endif
/*
fprintf( stderr, "\n" );
for( i=0; i<icyc; i++ ) fprintf( stderr,"%s\n", seq1[i] );
fprintf( stderr, "#####\n" );
for( j=0; j<jcyc; j++ ) fprintf( stderr,"%s\n", seq2[j] );
fprintf( stderr, "====>" );
for( i=0; i<icyc; i++ ) strcpy( mseq1[i], seq1[i] );
for( j=0; j<jcyc; j++ ) strcpy( mseq2[j], seq2[j] );
*/
if( constraint )
{
Atracking_localhom( impmatch, currentw, lastverticalw, seq1, seq2, mseq1, mseq2, ijp, icyc, jcyc, start1, end1, start2, end2, gapmap1, gapmap2, warpis, warpjs, warpbase );
}
else
Atracking( currentw, lastverticalw, seq1, seq2, mseq1, mseq2, ijp, icyc, jcyc, warpis, warpjs, warpbase );
if( warpis ) free( warpis );
if( warpjs ) free( warpjs );
// fprintf( stderr, "### impmatch = %f\n", *impmatch );
resultlen = strlen( mseq1[0] );
if( alloclen < resultlen || resultlen > N )
{
fprintf( stderr, "alloclen=%d, resultlen=%d, N=%d\n", alloclen, resultlen, N );
ErrorExit( "LENGTH OVER!\n" );
}
for( i=0; i<icyc; i++ ) strcpy( seq1[i], mseq1[i] );
for( j=0; j<jcyc; j++ ) strcpy( seq2[j], mseq2[j] );
/*
fprintf( stderr, "\n" );
for( i=0; i<icyc; i++ ) fprintf( stderr, "%s\n", mseq1[i] );
fprintf( stderr, "#####\n" );
for( j=0; j<jcyc; j++ ) fprintf( stderr, "%s\n", mseq2[j] );
*/
return( wm );
}
double partA__align_variousdist( int **which, double ***matrices, double **n_dynamicmtx, char **seq1, char **seq2, double *eff1, double *eff2, double **eff1s, double **eff2s, int icyc, int jcyc, int alloclen, int constraint, double *impmatch, int start1, int end1, int start2, int end2, int *gapmap1, int *gapmap2, char *sgap1, char *sgap2, char *egap1, char *egap2, int *chudanpt, int chudanref, int *chudanres )
/* score no keisan no sai motokaraaru gap no atukai ni mondai ga aru */
{
// int k;
register int i, j, c;
int lasti, lastj; /* outgap == 0 -> lgth1, outgap == 1 -> lgth1+1 */
int lgth1, lgth2;
int resultlen;
double wm = 0.0; /* int ?????? */
double g;
double *currentw, *previousw;
#if 1
double *wtmp;
int *ijppt;
double *mjpt, *prept, *curpt;
int *mpjpt;
#endif
static TLS double mi, *m;
static TLS int **ijp;
static TLS int mpi, *mp;
static TLS double *w1, *w2;
static TLS double *match;
static TLS double *initverticalw; /* kufuu sureba iranai */
static TLS double *lastverticalw; /* kufuu sureba iranai */
static TLS char **mseq1;
static TLS char **mseq2;
static TLS char **mseq;
static TLS double *ogcp1;
static TLS double *ogcp2;
static TLS double *fgcp1;
static TLS double *fgcp2;
static TLS double ***cpmx1s;
static TLS double ***cpmx2s;
static TLS double *gapfreq1;
static TLS double *gapfreq2;
static TLS int ***intwork;
static TLS double ***doublework;
static TLS int orlgth1 = 0, orlgth2 = 0;
double fpenalty = (double)penalty;
double fpenalty_shift = (double)penalty_shift;
#if USE_PENALTY_EX
double fpenalty_ex = (double)penalty_ex;
#endif
double *fgcp2pt;
double *ogcp2pt;
double fgcp1va;
double ogcp1va;
double *gf2pt;
double *gf2ptpre;
double gf1va;
double gf1vapre;
double headgapfreq1;
double headgapfreq2;
int *warpis = NULL;
int *warpjs = NULL;
int *warpi = NULL;
int *warpj = NULL;
int *prevwarpi = NULL;
int *prevwarpj = NULL;
double *wmrecords = NULL;
double *prevwmrecords = NULL;
int warpn = 0;
int warpbase;
double curm = 0.0;
double *wmrecordspt, *wmrecords1pt, *prevwmrecordspt;
int *warpipt, *warpjpt;
int *nmask, **masklist1, **masklist2;
if( seq1 == NULL )
{
if( orlgth1 )
{
// fprintf( stderr, "## Freeing local arrays in A__align\n" );
orlgth1 = 0;
orlgth2 = 0;
part_imp_match_init_strict( NULL, 0, 0, 0, 0, NULL, NULL, NULL, NULL, NULL, NULL, NULL, NULL, 0, NULL, NULL );
free( mseq1 );
free( mseq2 );
FreeFloatVec( w1 );
FreeFloatVec( w2 );
FreeFloatVec( match );
FreeFloatVec( initverticalw );
FreeFloatVec( lastverticalw );
FreeFloatVec( m );
FreeIntVec( mp );
FreeCharMtx( mseq );
FreeFloatVec( ogcp1 );
FreeFloatVec( ogcp2 );
FreeFloatVec( fgcp1 );
FreeFloatVec( fgcp2 );
FreeFloatCub( cpmx1s );
FreeFloatCub( cpmx2s );
FreeFloatVec( gapfreq1 );
FreeFloatVec( gapfreq2 );
FreeFloatCub( doublework );
FreeIntCub( intwork );
}
else
{
// fprintf( stderr, "## Not allocated\n" );
}
return( 0.0 );
}
masklist1 = AllocateIntMtx( maxdistclass, 0 );
masklist2 = AllocateIntMtx( maxdistclass, 0 );
nmask = calloc( maxdistclass, sizeof( int ) );
for( c=0; c<maxdistclass; c++ )
{
for( i=0; i<icyc; i++ ) for( j=0; j<jcyc; j++ )
{
if( eff1s[c][i] * eff2s[c][j] != 0.0 )
{
if( c != which[i][j] )
{
masklist1[c] = realloc( masklist1[c], sizeof( int ) * (nmask[c]+1) );
masklist2[c] = realloc( masklist2[c], sizeof( int ) * (nmask[c]+1) );
masklist1[c][nmask[c]] = i;
masklist2[c][nmask[c]] = j;
nmask[c]++;
}
}
}
}
for( c=0; c<maxdistclass; c++ ) if( nmask[c] ) break;
if( c<maxdistclass ) reporterr( "Found a complex grouping. This step may be a bit slow.\n" );
lgth1 = strlen( seq1[0] );
lgth2 = strlen( seq2[0] );
#if 1
// if( lgth1 == 0 ) fprintf( stderr, "WARNING: lgth1=0 in partA__align\n" );
// if( lgth2 == 0 ) fprintf( stderr, "WARNING: lgth2=0 in partA__align\n" );
if( lgth1 == 0 && lgth2 == 0 )
return( 0.0 );
if( lgth1 == 0 )
{
for( i=0; i<icyc; i++ )
{
j = lgth2;
seq1[i][j] = 0;
while( j ) seq1[i][--j] = *newgapstr;
// fprintf( stderr, "seq1[i] = %s\n", seq1[i] );
}
return( 0.0 );
}
if( lgth2 == 0 )
{
for( i=0; i<jcyc; i++ )
{
j = lgth1;
seq2[i][j] = 0;
while( j ) seq2[i][--j] = *newgapstr;
// fprintf( stderr, "seq2[i] = %s\n", seq2[i] );
}
return( 0.0 );
}
#endif
warpbase = lgth1 + lgth2;
warpis = NULL;
warpjs = NULL;
warpn = 0;
if( trywarp )
{
// fprintf( stderr, "IN partA__align_variousdist\n" );
if( outgap == 0 )
{
fprintf( stderr, "At present, outgap must be 1 to allow shift.\n" );
exit( 1 );
}
wmrecords = AllocateFloatVec( lgth2+1 );
warpi = AllocateIntVec( lgth2+1 );
warpj = AllocateIntVec( lgth2+1 );
prevwmrecords = AllocateFloatVec( lgth2+1 );
prevwarpi = AllocateIntVec( lgth2+1 );
prevwarpj = AllocateIntVec( lgth2+1 );
for( i=0; i<lgth2+1; i++ ) wmrecords[i] = 0.0;
for( i=0; i<lgth2+1; i++ ) prevwmrecords[i] = 0.0;
for( i=0; i<lgth2+1; i++ ) prevwarpi[i] = -warpbase;
for( i=0; i<lgth2+1; i++ ) prevwarpj[i] = -warpbase;
for( i=0; i<lgth2+1; i++ ) warpi[i] = -warpbase;
for( i=0; i<lgth2+1; i++ ) warpj[i] = -warpbase;
}
#if 0
fprintf( stderr, "eff in SA+++align\n" );
for( i=0; i<icyc; i++ ) fprintf( stderr, "eff1[%d] = %f\n", i, eff1[i] );
#endif
if( orlgth1 == 0 )
{
mseq1 = AllocateCharMtx( njob, 0 );
mseq2 = AllocateCharMtx( njob, 0 );
}
if( lgth1 > orlgth1 || lgth2 > orlgth2 )
{
int ll1, ll2;
if( orlgth1 > 0 && orlgth2 > 0 )
{
FreeFloatVec( w1 );
FreeFloatVec( w2 );
FreeFloatVec( match );
FreeFloatVec( initverticalw );
FreeFloatVec( lastverticalw );
FreeFloatVec( m );
FreeIntVec( mp );
FreeCharMtx( mseq );
FreeFloatVec( ogcp1 );
FreeFloatVec( ogcp2 );
FreeFloatVec( fgcp1 );
FreeFloatVec( fgcp2 );
FreeFloatCub( cpmx1s );
FreeFloatCub( cpmx2s );
FreeFloatVec( gapfreq1 );
FreeFloatVec( gapfreq2 );
FreeFloatCub( doublework );
FreeIntCub( intwork );
}
ll1 = MAX( (int)(1.3*lgth1), orlgth1 ) + 100;
ll2 = MAX( (int)(1.3*lgth2), orlgth2 ) + 100;
#if DEBUG
fprintf( stderr, "\ntrying to allocate (%d+%d)xn matrices ... ", ll1, ll2 );
#endif
w1 = AllocateFloatVec( ll2+2 );
w2 = AllocateFloatVec( ll2+2 );
match = AllocateFloatVec( ll2+2 );
initverticalw = AllocateFloatVec( ll1+2 );
lastverticalw = AllocateFloatVec( ll1+2 );
m = AllocateFloatVec( ll2+2 );
mp = AllocateIntVec( ll2+2 );
mseq = AllocateCharMtx( njob, ll1+ll2 );
ogcp1 = AllocateFloatVec( ll1+2 );
ogcp2 = AllocateFloatVec( ll2+2 );
fgcp1 = AllocateFloatVec( ll1+2 );
fgcp2 = AllocateFloatVec( ll2+2 );
cpmx1s = AllocateFloatCub( maxdistclass, nalphabets, ll1+2 );
cpmx2s = AllocateFloatCub( maxdistclass, nalphabets, ll2+2 );
gapfreq1 = AllocateFloatVec( ll1+2 );
gapfreq2 = AllocateFloatVec( ll2+2 );
doublework = AllocateFloatCub( maxdistclass, MAX( ll1, ll2 )+2, nalphabets );
intwork = AllocateIntCub( maxdistclass, MAX( ll1, ll2 )+2, nalphabets );
#if DEBUG
fprintf( stderr, "succeeded\n" );
#endif
orlgth1 = ll1 - 100;
orlgth2 = ll2 - 100;
}
for( i=0; i<icyc; i++ ) mseq1[i] = mseq[i];
for( j=0; j<jcyc; j++ ) mseq2[j] = mseq[icyc+j];
if( orlgth1 > commonAlloc1 || orlgth2 > commonAlloc2 )
{
int ll1, ll2;
if( commonAlloc1 && commonAlloc2 )
{
FreeIntMtx( commonIP );
}
ll1 = MAX( orlgth1, commonAlloc1 );
ll2 = MAX( orlgth2, commonAlloc2 );
#if DEBUG
fprintf( stderr, "\n\ntrying to allocate %dx%d matrices ... ", ll1+1, ll2+1 );
#endif
commonIP = AllocateIntMtx( ll1+10, ll2+10 );
#if DEBUG
fprintf( stderr, "succeeded\n\n" );
#endif
commonAlloc1 = ll1;
commonAlloc2 = ll2;
}
ijp = commonIP;
// cpmx_calc_new( seq1, cpmx1, eff1, lgth1, icyc );
// cpmx_calc_new( seq2, cpmx2, eff2, lgth2, jcyc );
for( c=0; c<maxdistclass; c++ )
{
cpmx_calc_new( seq1, cpmx1s[c], eff1s[c], lgth1, icyc );
cpmx_calc_new( seq2, cpmx2s[c], eff2s[c], lgth2, jcyc );
}
if( sgap1 )
{
new_OpeningGapCount( ogcp1, icyc, seq1, eff1, lgth1, sgap1 );
new_OpeningGapCount( ogcp2, jcyc, seq2, eff2, lgth2, sgap2 );
new_FinalGapCount( fgcp1, icyc, seq1, eff1, lgth1, egap1 );
new_FinalGapCount( fgcp2, jcyc, seq2, eff2, lgth2, egap2 );
outgapcount( &headgapfreq1, icyc, sgap1, eff1 );
outgapcount( &headgapfreq2, jcyc, sgap2, eff2 );
outgapcount( gapfreq1+lgth1, icyc, egap1, eff1 );
outgapcount( gapfreq2+lgth2, jcyc, egap2, eff2 );
}
else
{
st_OpeningGapCount( ogcp1, icyc, seq1, eff1, lgth1 );
st_OpeningGapCount( ogcp2, jcyc, seq2, eff2, lgth2 );
st_FinalGapCount( fgcp1, icyc, seq1, eff1, lgth1 );
st_FinalGapCount( fgcp2, jcyc, seq2, eff2, lgth2 );
headgapfreq1 = 0.0;
headgapfreq2 = 0.0;
gapfreq1[lgth1] = 0.0;
gapfreq2[lgth2] = 0.0;
}
if( legacygapcost == 0 )
{
gapcountf( gapfreq1, seq1, icyc, eff1, lgth1 );
gapcountf( gapfreq2, seq2, jcyc, eff2, lgth2 );
for( i=0; i<lgth1+1; i++ ) gapfreq1[i] = 1.0 - gapfreq1[i];
for( i=0; i<lgth2+1; i++ ) gapfreq2[i] = 1.0 - gapfreq2[i];
headgapfreq1 = 1.0 - headgapfreq1;
headgapfreq2 = 1.0 - headgapfreq2;
}
else
{
for( i=0; i<lgth1+1; i++ ) gapfreq1[i] = 1.0;
for( i=0; i<lgth2+1; i++ ) gapfreq2[i] = 1.0;
headgapfreq1 = 1.0;
headgapfreq2 = 1.0;
}
for( i=0; i<lgth1; i++ )
{
ogcp1[i] = 0.5 * ( 1.0 - ogcp1[i] ) * fpenalty * ( gapfreq1[i] );
fgcp1[i] = 0.5 * ( 1.0 - fgcp1[i] ) * fpenalty * ( gapfreq1[i] );
}
for( i=0; i<lgth2; i++ )
{
ogcp2[i] = 0.5 * ( 1.0 - ogcp2[i] ) * fpenalty * ( gapfreq2[i] );
fgcp2[i] = 0.5 * ( 1.0 - fgcp2[i] ) * fpenalty * ( gapfreq2[i] );
}
#if 0
for( i=0; i<lgth1; i++ )
fprintf( stderr, "ogcp1[%d]=%f\n", i, ogcp1[i] );
#endif
currentw = w1;
previousw = w2;
// match_calc( initverticalw, cpmx2, cpmx1, 0, lgth1, doublework, intwork, 1 );
fillzero( initverticalw, lgth1 );
for( c=0; c<maxdistclass; c++ )
{
match_calc_add( matrices[c], initverticalw, cpmx2s[c], cpmx1s[c], 0, lgth1, doublework[c], intwork[c], 1 );
if( nmask[c] ) match_calc_del( which, matrices, initverticalw, jcyc, seq2, eff2, icyc, seq1, eff1, 0, lgth1, c, nmask[c], masklist2[c], masklist1[c] );
}
if( constraint )
part_imp_match_out_vead_tate_gapmap( initverticalw, gapmap2[0]+start2, lgth1, start1, gapmap1 );
// match_calc( currentw, cpmx1, cpmx2, 0, lgth2, doublework, intwork, 1 );
fillzero( currentw, lgth2 );
for( c=0; c<maxdistclass; c++ )
{
match_calc_add( matrices[c], currentw, cpmx1s[c], cpmx2s[c], 0, lgth2, doublework[c], intwork[c], 1 );
if( nmask[c] ) match_calc_del( which, matrices, currentw, icyc, seq1, eff1, jcyc, seq2, eff2, 0, lgth2, c, nmask[c], masklist1[c], masklist2[c] );
}
if( constraint )
part_imp_match_out_vead_gapmap( currentw, gapmap1[0]+start1, lgth2, start2, gapmap2 );
#if 0 // -> tbfast.c, localhom ga hitsuyou
if( localhom )
imp_match_calc( currentw, icyc, jcyc, lgth1, lgth2, seq1, seq2, eff1, eff2, localhom, 1, 0 );
#endif
if( outgap == 1 )
{
for( i=1; i<lgth1+1; i++ )
{
// initverticalw[i] += ( ogcp1[0] + fgcp1[i-1] ) ;
initverticalw[i] += ( ogcp1[0] * headgapfreq2 + fgcp1[i-1] * gapfreq2[0] ) ;
#if USE_PENALTY_EX
tsuika hitsuyou
#endif
}
for( j=1; j<lgth2+1; j++ )
{
// currentw[j] += ( ogcp2[0] + fgcp2[j-1] ) ;
currentw[j] += ( ogcp2[0] * headgapfreq1 + fgcp2[j-1] * gapfreq1[0] ) ;
#if USE_PENALTY_EX
tsuika hitsuyou
#endif
}
}
#if OUTGAP0TRY
else
{
for( j=1; j<lgth2+1; j++ )
currentw[j] -= offset * j / 2.0;
for( i=1; i<lgth1+1; i++ )
initverticalw[i] -= offset * i / 2.0;
}
#endif
for( j=1; j<lgth2+1; ++j )
{
// m[j] = currentw[j-1] + ogcp1[1]; mp[j] = 0;
m[j] = currentw[j-1] + ogcp1[1] * gapfreq2[j-1]; mp[j] = 0;;
}
lastverticalw[0] = currentw[lgth2-1];
if( outgap ) lasti = lgth1+1; else lasti = lgth1;
lastj = lgth2+1;
#if XXXXXXX
fprintf( stderr, "currentw = \n" );
for( i=0; i<lgth1+1; i++ )
{
fprintf( stderr, "%5.2f ", currentw[i] );
}
fprintf( stderr, "\n" );
fprintf( stderr, "initverticalw = \n" );
for( i=0; i<lgth2+1; i++ )
{
fprintf( stderr, "%5.2f ", initverticalw[i] );
}
fprintf( stderr, "\n" );
fprintf( stderr, "fcgp\n" );
for( i=0; i<lgth1; i++ )
fprintf( stderr, "fgcp1[%d]=%f\n", i, ogcp1[i] );
for( i=0; i<lgth2; i++ )
fprintf( stderr, "fgcp2[%d]=%f\n", i, ogcp2[i] );
#endif
for( i=1; i<lasti; i++ )
{
#ifdef enablemultithread
// fprintf( stderr, "chudan = %d, %d\n", *chudanpt, chudanref );
if( chudanpt && *chudanpt != chudanref )
{
// fprintf( stderr, "\n\n## CHUUDAN!!! i\n" );
*chudanres = 1;
if( masklist1 ) freeintmtx( masklist1, maxdistclass ); masklist1 = NULL;
if( masklist2 ) freeintmtx( masklist2, maxdistclass ); masklist2 = NULL;
if( nmask ) free( nmask ); nmask = NULL;
return( -1.0 );
}
#endif
wtmp = previousw;
previousw = currentw;
currentw = wtmp;
previousw[0] = initverticalw[i-1];
// match_calc( currentw, cpmx1, cpmx2, i, lgth2, doublework, intwork, 0 );
fillzero( currentw, lgth2 );
for( c=0; c<maxdistclass; c++ )
{
match_calc_add( matrices[c], currentw, cpmx1s[c], cpmx2s[c], i, lgth2, doublework[c], intwork[c], 0 );
if( nmask[c] ) match_calc_del( which, matrices, currentw, icyc, seq1, eff1, jcyc, seq2, eff2, i, lgth2, c, nmask[c], masklist1[c], masklist2[c] );
}
#if 0
fprintf( stderr, "\n" );
fprintf( stderr, "i=%d\n", i );
fprintf( stderr, "currentw before imp = \n" );
for( j=0; j<lgth2; j++ )
{
fprintf( stderr, "%5.2f ", currentw[j] );
}
fprintf( stderr, "\n" );
#endif
if( constraint )
{
// fprintf( stderr, "Calling imp_match_calc (o) lgth = %d, i = %d\n", lgth1, i );
// imp_match_out_vead( currentw, i, lgth2 );
part_imp_match_out_vead_gapmap( currentw, gapmap1[i]+start1, lgth2, start2, gapmap2 );
}
#if 0
fprintf( stderr, "specificity = %f\n", specificityconsideration );
fprintf( stderr, "i=%d\n", i );
fprintf( stderr, "currentw = \n" );
for( j=0; j<lgth2; j++ )
{
fprintf( stderr, "%5.2f ", currentw[j] );
}
fprintf( stderr, "\n" );
#endif
currentw[0] = initverticalw[i];
// mi = previousw[0] + ogcp2[1]; mpi = 0;
mi = previousw[0] + ogcp2[1] * gapfreq1[i-1]; mpi=0;
ijppt = ijp[i] + 1;
mjpt = m + 1;
prept = previousw;
curpt = currentw + 1;
mpjpt = mp + 1;
fgcp2pt = fgcp2;
ogcp2pt = ogcp2+1;
fgcp1va = fgcp1[i-1];
ogcp1va = ogcp1[i];
gf1va = gapfreq1[i];
gf1vapre = gapfreq1[i-1];
gf2pt = gapfreq2+1;
gf2ptpre = gapfreq2;
if( trywarp )
{
prevwmrecordspt = prevwmrecords;
wmrecordspt = wmrecords+1;
wmrecords1pt = wmrecords;
warpipt = warpi + 1;
warpjpt = warpj + 1;
}
for( j=1; j<lastj; j++ )
{
#ifdef xxxenablemultithread
// fprintf( stderr, "chudan = %d, %d\n", *chudanpt, chudanref );
if( chudanpt && *chudanpt != chudanref )
{
// fprintf( stderr, "\n\n## CHUUDAN!!! j\n" );
*chudanres = 1;
if( masklist1 ) freeintmtx( masklist1, maxdistclass ); masklist1 = NULL;
if( masklist2 ) freeintmtx( masklist2, maxdistclass ); masklist2 = NULL;
if( nmask ) free( nmask ); nmask = NULL;
return( -1.0 );
}
#endif
wm = *prept;
*ijppt = 0;
#if 0
fprintf( stderr, "%5.0f->", wm );
#endif
// g = mi + *fgcp2pt * gapfreq1[i];
if( (g = mi + *fgcp2pt * gf1va) > wm )
{
wm = g;
*ijppt = -( j - mpi );
}
// g = *prept + *ogcp2pt * gapfreq1[i-1];
// if( (g = *prept + *ogcp2pt * gf1vapre) >= mi )
if( (g = *prept + *ogcp2pt * gf1vapre) > mi ) // 2018/Apr
{
mi = g;
mpi = j-1;
}
#if USE_PENALTY_EX
mi += fpenalty_ex;
#endif
// g = *mjpt + fgcp1va * gapfreq2[j];
if( (g = *mjpt + fgcp1va * *gf2pt) > wm )
{
wm = g;
*ijppt = +( i - *mpjpt );
}
// g = *prept + ogcp1va * gapfreq2[j-1];
// if( (g = *prept + ogcp1va * *gf2ptpre) >= *mjpt )
if( (g = *prept + ogcp1va * *gf2ptpre) > *mjpt ) // 2018/Apr
{
*mjpt = g;
*mpjpt = i-1;
}
#if USE_PENALTY_EX
m[j] += fpenalty_ex;
#endif
if( trywarp )
{
#if USE_PENALTY_EX
if( ( g=*prevwmrecordspt++ + fpenalty_shift + fpenalty_ex * ( i - prevwarpi[j-1] + j - prevwarpj[j-1] ) ) > wm ) // naka ha osokute kamawanai
#else
if( ( g=*prevwmrecordspt++ + fpenalty_shift ) > wm ) // naka ha osokute kamawanai
#endif
{
if( warpn && prevwarpi[j-1] == warpis[warpn-1] && prevwarpj[j-1] == warpjs[warpn-1] )
{
*ijppt = warpbase + warpn - 1;
}
else
{
*ijppt = warpbase + warpn;
warpis = realloc( warpis, sizeof(int) * ( warpn+1 ) );
warpjs = realloc( warpjs, sizeof(int) * ( warpn+1 ) );
warpis[warpn] = prevwarpi[j-1];
warpjs[warpn] = prevwarpj[j-1];
warpn++;
}
wm = g;
}
curm = *curpt + wm;
if( *wmrecords1pt > *wmrecordspt )
{
*wmrecordspt = *wmrecords1pt;
*warpipt = *(warpipt-1);
*warpjpt = *(warpjpt-1);
}
if( curm > *wmrecordspt )
{
*wmrecordspt = curm;
*warpipt = i;
*warpjpt = j;
}
wmrecordspt++;
wmrecords1pt++;
warpipt++;
warpjpt++;
}
#if 0
fprintf( stderr, "%5.0f ", wm );
#endif
*curpt += wm;
ijppt++;
mjpt++;
prept++;
mpjpt++;
curpt++;
fgcp2pt++;
ogcp2pt++;
gf2ptpre++;
gf2pt++;
}
lastverticalw[i] = currentw[lgth2-1];
if( trywarp )
{
fltncpy( prevwmrecords, wmrecords, lastj );
intncpy( prevwarpi, warpi, lastj );
intncpy( prevwarpj, warpj, lastj );
}
}
if( trywarp )
{
// fprintf( stderr, "wm = %f\n", wm );
// fprintf( stderr, "warpn = %d\n", warpn );
free( wmrecords );
free( prevwmrecords );
free( warpi );
free( warpj );
free( prevwarpi );
free( prevwarpj );
}
#if OUTGAP0TRY
if( !outgap )
{
for( j=1; j<lgth2+1; j++ )
currentw[j] -= offset * ( lgth2 - j ) / 2.0;
for( i=1; i<lgth1+1; i++ )
lastverticalw[i] -= offset * ( lgth1 - i / 2.0);
}
#endif
/*
fprintf( stderr, "\n" );
for( i=0; i<icyc; i++ ) fprintf( stderr,"%s\n", seq1[i] );
fprintf( stderr, "#####\n" );
for( j=0; j<jcyc; j++ ) fprintf( stderr,"%s\n", seq2[j] );
fprintf( stderr, "====>" );
for( i=0; i<icyc; i++ ) strcpy( mseq1[i], seq1[i] );
for( j=0; j<jcyc; j++ ) strcpy( mseq2[j], seq2[j] );
*/
if( constraint )
{
Atracking_localhom( impmatch, currentw, lastverticalw, seq1, seq2, mseq1, mseq2, ijp, icyc, jcyc, start1, end1, start2, end2, gapmap1, gapmap2, warpis, warpjs, warpbase );
}
else
Atracking( currentw, lastverticalw, seq1, seq2, mseq1, mseq2, ijp, icyc, jcyc, warpis, warpjs, warpbase );
if( warpis ) free( warpis );
if( warpjs ) free( warpjs );
// fprintf( stderr, "### impmatch = %f\n", *impmatch );
resultlen = strlen( mseq1[0] );
if( alloclen < resultlen || resultlen > N )
{
fprintf( stderr, "alloclen=%d, resultlen=%d, N=%d\n", alloclen, resultlen, N );
ErrorExit( "LENGTH OVER!\n" );
}
for( i=0; i<icyc; i++ ) strcpy( seq1[i], mseq1[i] );
for( j=0; j<jcyc; j++ ) strcpy( seq2[j], mseq2[j] );
/*
fprintf( stderr, "\n" );
for( i=0; i<icyc; i++ ) fprintf( stderr, "%s\n", mseq1[i] );
fprintf( stderr, "#####\n" );
for( j=0; j<jcyc; j++ ) fprintf( stderr, "%s\n", mseq2[j] );
*/
if( masklist1 ) freeintmtx( masklist1, maxdistclass ); masklist1 = NULL;
if( masklist2 ) freeintmtx( masklist2, maxdistclass ); masklist2 = NULL;
if( nmask ) free( nmask ); nmask = NULL;
return( wm );
}