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/* $Id: seqcons.c,v 6.23 2000/05/05 13:28:59 thiessen Exp $
* ===========================================================================
*
* PUBLIC DOMAIN NOTICE
* National Center for Biotechnology Information (NCBI)
*
* This software/database is a "United States Government Work" under the
* terms of the United States Copyright Act. It was written as part of
* the author's official duties as a United States Government employee and
* thus cannot be copyrighted. This software/database is freely available
* to the public for use. The National Library of Medicine and the U.S.
* Government do not place any restriction on its use or reproduction.
* We would, however, appreciate having the NCBI and the author cited in
* any work or product based on this material
*
* Although all reasonable efforts have been taken to ensure the accuracy
* and reliability of the software and data, the NLM and the U.S.
* Government do not and cannot warrant the performance or results that
* may be obtained by using this software or data. The NLM and the U.S.
* Government disclaim all warranties, express or implied, including
* warranties of performance, merchantability or fitness for any particular
* purpose.
*
* ===========================================================================
*
* File Name: $Id: seqcons.c,v 6.23 2000/05/05 13:28:59 thiessen Exp $
*
* Authors: Paul Thiessen
*
* Version Creation Date: 2/10/2000
*
* File Description: to calculate colors for columns to visualize
* sequence conservation
*
* Modifications:
* --------------------------------------------------------------------------
* $Log: seqcons.c,v $
* Revision 6.23 2000/05/05 13:28:59 thiessen
* fix to handle updated profiler
*
* Revision 6.22 2000/04/27 13:36:19 thiessen
* change algorithm GUI names
*
* Revision 6.21 2000/04/11 17:14:20 thiessen
* remove warning for zero-length alignment
*
* Revision 6.20 2000/04/06 19:03:20 thiessen
* new BLOSUM62 conservation coloring
*
* Revision 6.19 2000/04/06 14:49:46 thiessen
* minor optimizations
*
* Revision 6.18 2000/04/04 15:50:45 thiessen
* fix coloring when aligned gaps present
*
* Revision 6.17 2000/03/21 14:16:11 thiessen
* improved color ramp for variety scheme
*
* Revision 6.16 2000/03/17 22:49:00 thiessen
* fix for multi-chain / multi-model features ; added feature-move ; misc bug fixes
*
* Revision 6.15 2000/03/16 20:31:45 thiessen
* fixes to color; new color-by-variety algorithm
*
* Revision 6.14 2000/03/14 18:03:14 thiessen
* add target row to MMD; remove rowmgr
*
* Revision 6.13 2000/03/03 20:05:17 thiessen
* removal of palette-building pass if in 24-bit color
*
* Revision 6.12 2000/03/03 14:22:29 thiessen
* moved back into ncbicn3d
*
* Revision 1.1 2000/03/02 21:20:41 thiessen
* many improvements, moved into object library
*
* Revision 6.10 2000/02/25 02:53:15 thiessen
* check AlignMgr rather than bAligned flag to see if a residue is aligned
*
* Revision 6.9 2000/02/23 18:56:30 thiessen
* move to 1-based row numbers
*
* Revision 6.8 2000/02/19 21:25:58 thiessen
* split of cn3dmodl into cn3dmodl and cn3dstyl
*
* Revision 6.7 2000/02/17 15:41:11 thiessen
* added CSC algorithm selection submenu
*
* Revision 6.6 2000/02/16 21:25:31 thiessen
* new row manager module; made Cn3D use row-wise color storage for aligned strucs
*
* Revision 6.5 2000/02/16 14:02:00 thiessen
* further progress on seqcons module
*
* Revision 6.4 2000/02/14 21:22:00 kans
* include seqcons.h after other includes, to pick up SeqAlign, SeqId, etc., otherwise types undefined at first use
*
* Revision 6.3 2000/02/14 20:04:23 thiessen
* another fix for solvent; more filling in of seqcons
*
* Revision 6.2 2000/02/14 12:32:31 thiessen
* fix solvent identification; progress on seqcons module
*
* Revision 6.1 2000/02/11 01:12:35 thiessen
* new module for sequence conservation coloring
*
*
*
* ==========================================================================
*/
#include <vibrant.h>
#include <objseq.h>
#include <mmdbapi.h>
#include <alignmgr.h>
#include <actutils.h>
#include <seqcons.h>
#include <seqmgr.h>
#include <viewmgr.h>
#define MESSAGE_TYPE MSG_POST
#define ERR_RETURN(msg) do { \
Message(MESSAGE_TYPE, "Color-by-conservation module error: %s", (msg)); \
return; \
} while (0)
#define ERR_RETURN_VAL(msg, val) do { \
Message(MESSAGE_TYPE, "Color-by-conservation module error: %s", (msg)); \
return (val); \
} while (0)
/**** data structures to hold column colors ****/
static Nlm_UcharPtr CSC_CurrentColors = NULL;
static Nlm_Int4 CSC_CurrentNColumns = 0;
static int CSC_CurrentProfileRows;
/**** data structures to hold row/SeqId index ****/
static SeqAlignPtr CSC_CurrentSeqAlign = NULL;
static ACTProfilePtr CSC_CurrentProfile = NULL;
/**** functions to access color data ****/
static Nlm_Int4 CSC_GetColumnColorByRowAndAlignLoc(Nlm_Int4 row, Nlm_Int4 alignLoc)
{
if (alignLoc < 0 || alignLoc >= CSC_CurrentNColumns)
ERR_RETURN_VAL("alignLoc out of range", CSC_COLOR_ERROR);
else
return ((CSC_CurrentColors[3*alignLoc] << 16) +
(CSC_CurrentColors[3*alignLoc+1] << 8) +
CSC_CurrentColors[3*alignLoc+2]);
}
Nlm_Int4 CSC_GetColumnColorByRow(Nlm_Int4 row, Nlm_Int4 seqLoc)
{
Nlm_Int4 alignLoc = -1;
if (row <= 0)
return CSC_COLOR_ERROR;
/* determine alignment location (column) from bioseq location */
alignLoc = AlnMgrMapBioseqToSeqAlign(CSC_CurrentSeqAlign, seqLoc, row, NULL);
/* then return the appropriate column color */
if (alignLoc < 0)
ERR_RETURN_VAL("can't map seqLoc to alignLoc", CSC_COLOR_ERROR);
if (alignLoc >= CSC_CurrentNColumns) {
#ifdef _DEBUG
Message(MSG_POST,"row %i, seqloc %i, alignloc %i, align len %i",
row, seqLoc, alignLoc, CSC_CurrentNColumns);
#endif
ERR_RETURN_VAL("alignLoc out of range", CSC_COLOR_ERROR);
}
return CSC_GetColumnColorByRowAndAlignLoc(row, alignLoc);
}
/**** functions for various algorithms to assign colors based on profile ****/
typedef void (*CSC_AlgorithmFunc)(void); /* must all be of this type */
static Nlm_Uint1 CSC_FullIdentityColor[3] = { 255, 25, 25 },
CSC_ZeroIdentityColor[3] = { 100, 100, 255 };
/* ramp depending on how many different residue types are present */
static void CSC_Algorithm_ShowVariety(void)
{
static int *variety = NULL, vSize = -1;
ACTProfilePtr app;
int c, pr, offset, maxResTypes = 1, nResTypes, nRows, i = 0;
Nlm_Int4 foundFlags, typeBit;
double scale;
FloatHi freqSum;
/* static cache for color varieties */
if (vSize != CSC_CurrentNColumns) {
if (variety) MemFree(variety);
variety = (int *) MemNew(CSC_CurrentNColumns * sizeof(int));
if (!variety) return;
vSize = CSC_CurrentNColumns;
}
nRows = AlnMgrGetNumRows(CSC_CurrentSeqAlign);
/* first determine column variation and max */
for (app = CSC_CurrentProfile; app; app = app->next) {
for (c = 0; c < app->len; c++) {
foundFlags = nResTypes = 0;
freqSum = 0.0;
for (pr = 1; pr < CSC_CurrentProfileRows; pr++) {
if (((int) (app->freq[pr][c] + 0.001)) > 0) {
freqSum += app->freq[pr][c];
typeBit = ((Nlm_Int4) 1) << pr;
if (!(foundFlags & typeBit)) {
nResTypes++;
foundFlags |= typeBit;
}
}
}
/* each gap counts as an additional variety */
nResTypes += nRows - app->numseq;
nResTypes += app->numseq - ((int) (freqSum + 0.001));
variety[i++] = nResTypes;
if (nResTypes > maxResTypes)
maxResTypes = nResTypes;
}
}
/* then color according to variety in each column, normalized by max variety */
for (i = 0; i < CSC_CurrentNColumns; i++) {
nResTypes = variety[i];
if (maxResTypes == 1)
scale = 0.0;
else
/* scale [1..maxResTypes] onto [0..1] */
scale = 1.0 * (nResTypes - 1) / (maxResTypes - 1);
offset = 3 * i;
CSC_CurrentColors[offset] = (Nlm_Uint1)
(scale * (CSC_ZeroIdentityColor[0] - CSC_FullIdentityColor[0])
+ CSC_FullIdentityColor[0]);
CSC_CurrentColors[offset+1] = (Nlm_Uint1)
(scale * (CSC_ZeroIdentityColor[1] - CSC_FullIdentityColor[1])
+ CSC_FullIdentityColor[1]);
CSC_CurrentColors[offset+2] = (Nlm_Uint1)
(scale * (CSC_ZeroIdentityColor[2] - CSC_FullIdentityColor[2])
+ CSC_FullIdentityColor[2]);
}
}
/* stuff for BLOSUM coloring */
#define CSC_BLOSUMSIZE 24
static const char CSC_Blosum62Fields[CSC_BLOSUMSIZE] =
{ 'A', 'R', 'N', 'D', 'C', 'Q', 'E', 'G', 'H', 'I', 'L', 'K', 'M',
'F', 'P', 'S', 'T', 'W', 'Y', 'V', 'B', 'Z', 'X', '*' };
static const Nlm_Int1 CSC_Blosum62Matrix[CSC_BLOSUMSIZE][CSC_BLOSUMSIZE] = {
/* A, R, N, D, C, Q, E, G, H, I, L, K, M, F, P, S, T, W, Y, V, B, Z, X, * */
/*A*/ { 4, -1, -2, -2, 0, -1, -1, 0, -2, -1, -1, -1, -1, -2, -1, 1, 0, -3, -2, 0, -2, -1, 0, -4 },
/*R*/ { -1, 5, 0, -2, -3, 1, 0, -2, 0, -3, -2, 2, -1, -3, -2, -1, -1, -3, -2, -3, -1, 0, -1, -4 },
/*N*/ { -2, 0, 6, 1, -3, 0, 0, 0, 1, -3, -3, 0, -2, -3, -2, 1, 0, -4, -2, -3, 3, 0, -1, -4 },
/*D*/ { -2, -2, 1, 6, -3, 0, 2, -1, -1, -3, -4, -1, -3, -3, -1, 0, -1, -4, -3, -3, 4, 1, -1, -4 },
/*C*/ { 0, -3, -3, -3, 9, -3, -4, -3, -3, -1, -1, -3, -1, -2, -3, -1, -1, -2, -2, -1, -3, -3, -2, -4 },
/*Q*/ { -1, 1, 0, 0, -3, 5, 2, -2, 0, -3, -2, 1, 0, -3, -1, 0, -1, -2, -1, -2, 0, 3, -1, -4 },
/*E*/ { -1, 0, 0, 2, -4, 2, 5, -2, 0, -3, -3, 1, -2, -3, -1, 0, -1, -3, -2, -2, 1, 4, -1, -4 },
/*G*/ { 0, -2, 0, -1, -3, -2, -2, 6, -2, -4, -4, -2, -3, -3, -2, 0, -2, -2, -3, -3, -1, -2, -1, -4 },
/*H*/ { -2, 0, 1, -1, -3, 0, 0, -2, 8, -3, -3, -1, -2, -1, -2, -1, -2, -2, 2, -3, 0, 0, -1, -4 },
/*I*/ { -1, -3, -3, -3, -1, -3, -3, -4, -3, 4, 2, -3, 1, 0, -3, -2, -1, -3, -1, 3, -3, -3, -1, -4 },
/*L*/ { -1, -2, -3, -4, -1, -2, -3, -4, -3, 2, 4, -2, 2, 0, -3, -2, -1, -2, -1, 1, -4, -3, -1, -4 },
/*K*/ { -1, 2, 0, -1, -3, 1, 1, -2, -1, -3, -2, 5, -1, -3, -1, 0, -1, -3, -2, -2, 0, 1, -1, -4 },
/*M*/ { -1, -1, -2, -3, -1, 0, -2, -3, -2, 1, 2, -1, 5, 0, -2, -1, -1, -1, -1, 1, -3, -1, -1, -4 },
/*F*/ { -2, -3, -3, -3, -2, -3, -3, -3, -1, 0, 0, -3, 0, 6, -4, -2, -2, 1, 3, -1, -3, -3, -1, -4 },
/*P*/ { -1, -2, -2, -1, -3, -1, -1, -2, -2, -3, -3, -1, -2, -4, 7, -1, -1, -4, -3, -2, -2, -1, -2, -4 },
/*S*/ { 1, -1, 1, 0, -1, 0, 0, 0, -1, -2, -2, 0, -1, -2, -1, 4, 1, -3, -2, -2, 0, 0, 0, -4 },
/*T*/ { 0, -1, 0, -1, -1, -1, -1, -2, -2, -1, -1, -1, -1, -2, -1, 1, 5, -2, -2, 0, -1, -1, 0, -4 },
/*W*/ { -3, -3, -4, -4, -2, -2, -3, -2, -2, -3, -2, -3, -1, 1, -4, -3, -2, 11, 2, -3, -4, -3, -2, -4 },
/*Y*/ { -2, -2, -2, -3, -2, -1, -2, -3, 2, -1, -1, -2, -1, 3, -3, -2, -2, 2, 7, -1, -3, -2, -1, -4 },
/*V*/ { 0, -3, -3, -3, -1, -2, -2, -3, -3, 3, 1, -2, 1, -1, -2, -2, 0, -3, -1, 4, -3, -2, -1, -4 },
/*B*/ { -2, -1, 3, 4, -3, 0, 1, -1, 0, -3, -4, 0, -3, -3, -2, 0, -1, -4, -3, -3, 4, 1, -1, -4 },
/*Z*/ { -1, 0, 0, 1, -3, 3, 4, -2, 0, -3, -3, 1, -1, -3, -1, 0, -1, -3, -2, -2, 1, 4, -1, -4 },
/*X*/ { 0, -1, -1, -1, -2, -1, -1, -1, -1, -1, -1, -1, -1, -1, -2, 0, 0, -2, -1, -1, -1, -1, -1, -4 },
/***/ { -4, -4, -4, -4, -4, -4, -4, -4, -4, -4, -4, -4, -4, -4, -4, -4, -4, -4, -4, -4, -4, -4, -4, 1 }
};
/* returns BLOSUM score, based values for an aa according to NCBIstdaa */
static Nlm_Int1 CSC_GetBlosumScore(int value1, int value2)
{
int index1, index2, i, value, index;
for (i = 0; i < 2; i++) {
value = (i==0) ? value1 : value2;
switch (value) { /* map NCBIstdaa "value" onto index in BLOSUM matrix */
case 1: index = 0; break;
case 2: index = 20; break;
case 3: case 24: index = 4; break;
case 4: index = 3; break;
case 5: index = 6; break;
case 6: index = 13; break;
case 7: index = 7; break;
case 8: index = 8; break;
case 9: index = 9; break;
case 10: index = 11; break;
case 11: index = 10; break;
case 12: index = 12; break;
case 13: index = 2; break;
case 14: index = 14; break;
case 15: index = 5; break;
case 16: index = 1; break;
case 17: index = 15; break;
case 18: index = 16; break;
case 19: index = 19; break;
case 20: index = 17; break;
case 21: index = 22; break;
case 22: index = 18; break;
case 23: index = 21; break;
default: index = -1; break;
}
if (i==0) index1 = index; else index2 = index;
}
if (index1 < 0 || index2 < 0)
return -4;
else
return CSC_Blosum62Matrix[index1][index2];
}
/* ramp depending on sum of pairwise BLOSUM scores */
static void CSC_Algorithm_ByBlosum62(void)
{
static int *score = NULL, vSize = -1;
ACTProfilePtr app;
int c, pr1, pr2, offset, maxScore, minScore, nRows, i = 0, sum, nGaps;
double scale;
FloatHi freqSum;
if (CSC_CurrentProfile->nuc) {
Message(MSG_POST, "Can't do BLOSUM coloring on nucleotides!\nWill do \"Variety\" coloring instead.");
CSC_Algorithm_ShowVariety();
return;
}
/* static cache for score totals */
if (vSize != CSC_CurrentNColumns) {
if (score) MemFree(score);
score = (int *) MemNew(CSC_CurrentNColumns * sizeof(int));
if (!score) return;
vSize = CSC_CurrentNColumns;
}
nRows = AlnMgrGetNumRows(CSC_CurrentSeqAlign);
/* first determine column sums, min and max */
for (app = CSC_CurrentProfile; app; app = app->next) {
for (c = 0; c < app->len; c++) {
sum = 0;
freqSum = 0.0;
/* count all "identity" pair scores */
for (pr1 = 1; pr1 < 26; pr1++) {
sum += ((int) (app->freq[pr1][c] * (app->freq[pr1][c] - 1) / 2 + 0.001))
* CSC_GetBlosumScore(pr1, pr1);
freqSum += app->freq[pr1][c];
}
/* then count all non-identical pairs */
for (pr1 = 1; pr1 < 26 - 1; pr1++) {
for (pr2 = pr1 + 1; pr2 < 26; pr2++) {
sum += ((int) (app->freq[pr1][c] * app->freq[pr2][c] + 0.001))
* CSC_GetBlosumScore(pr1, pr2);
}
}
/* then count all pairs with (and amongst) gaps */
nGaps = nRows - app->numseq;
nGaps += app->numseq - ((int) (freqSum + 0.001));
sum += (nGaps * (nGaps - 1) / 2 + nGaps * (nRows - nGaps))
* CSC_GetBlosumScore(-1, -1);
score[i] = sum;
if (i == 0 || score[i] > maxScore)
maxScore = score[i];
if (i == 0 || score[i] < minScore)
minScore = score[i];
i++;
}
}
/* then color according to score in each column, normalized by max score */
for (i = 0; i < CSC_CurrentNColumns; i++) {
if (minScore == maxScore)
scale = 0.0;
else
/* scale [minScore..maxScore] onto [1..0] */
scale = 1.0 - 1.0 * (score[i] - minScore) / (maxScore - minScore);
offset = 3 * i;
CSC_CurrentColors[offset] = (Nlm_Uint1)
(scale * (CSC_ZeroIdentityColor[0] - CSC_FullIdentityColor[0])
+ CSC_FullIdentityColor[0]);
CSC_CurrentColors[offset+1] = (Nlm_Uint1)
(scale * (CSC_ZeroIdentityColor[1] - CSC_FullIdentityColor[1])
+ CSC_FullIdentityColor[1]);
CSC_CurrentColors[offset+2] = (Nlm_Uint1)
(scale * (CSC_ZeroIdentityColor[2] - CSC_FullIdentityColor[2])
+ CSC_FullIdentityColor[2]);
}
}
/* simply one of two colors, for 100% column identity or not */
static void CSC_Algorithm_ShowIdentity(void)
{
ACTProfilePtr app = CSC_CurrentProfile;
int c, pr, offset = 0;
int nRows = AlnMgrGetNumRows(CSC_CurrentSeqAlign);
for (; app; app = app->next) {
for (c = 0; c < app->len; offset += 3, c++) {
for (pr = 1; pr < CSC_CurrentProfileRows; pr++) {
if (((int) (app->freq[pr][c] + 0.001)) == 0) continue;
else if (((int) (app->freq[pr][c] + 0.001)) == nRows) {
CSC_CurrentColors[offset] = CSC_FullIdentityColor[0];
CSC_CurrentColors[offset+1] = CSC_FullIdentityColor[1];
CSC_CurrentColors[offset+2] = CSC_FullIdentityColor[2];
} else {
CSC_CurrentColors[offset] = CSC_ZeroIdentityColor[0];
CSC_CurrentColors[offset+1] = CSC_ZeroIdentityColor[1];
CSC_CurrentColors[offset+2] = CSC_ZeroIdentityColor[2];
}
break;
}
}
}
}
/* simply color all aligned residues a single color */
static void CSC_Algorithm_ShowAligned(void)
{
int c, offset = 0;
for (c = 0; c < CSC_CurrentNColumns; c++) {
CSC_CurrentColors[offset] = CSC_FullIdentityColor[0];
CSC_CurrentColors[offset+1] = CSC_FullIdentityColor[1];
CSC_CurrentColors[offset+2] = CSC_FullIdentityColor[2];
offset += 3;
}
}
/**** to manage which algorithm is used ****/
typedef struct _CSC_AlgorithmFuncListItem {
Nlm_Int2 type;
Nlm_CharPtr name;
CSC_AlgorithmFunc function;
} CSC_AlgorithmFuncListItem;
/* must be in the same order as the enum in seqcons.h */
static CSC_AlgorithmFuncListItem CSC_AlgorithmFuncList[] = {
{ CSC_BYVARIETY, "Variety", CSC_Algorithm_ShowVariety },
{ CSC_BYBLOSUM62, "Weighted Variety", CSC_Algorithm_ByBlosum62 },
{ CSC_SHOWIDENTITY, "Identity", CSC_Algorithm_ShowIdentity },
{ CSC_SHOWALIGNED, "Aligned", CSC_Algorithm_ShowAligned }
};
static Nlm_Int2 CSC_CurrentAlgorithm = -1;
const Nlm_Char * CSC_GetAlgorithmName(Nlm_Int2 which)
{
if (which >= 0 && which < CSC_NUMALGORITHMS)
return CSC_AlgorithmFuncList[which].name;
ERR_RETURN_VAL("invalid algorithm identity", NULL);
}
/**** functions to calculate and access column colors ****/
/* calculate and store column colors for an alignment */
Nlm_Boolean CSC_CalculateColumnColors(SeqAlignPtr salp, Nlm_Int2 useAlgorithm)
{
ACTProfilePtr app;
int len;
/* if passed a null pointer, then clear the current stores */
if (!salp) {
if (CSC_CurrentColors) MemFree(CSC_CurrentColors);
if (CSC_CurrentProfile) ACT_ProfileSetFree(CSC_CurrentProfile);
CSC_CurrentColors = NULL;
CSC_CurrentSeqAlign = NULL;
CSC_CurrentProfile = NULL;
CSC_CurrentNColumns = 0;
CSC_CurrentAlgorithm = -1;
return FALSE;
}
CSC_CurrentAlgorithm = useAlgorithm;
CSC_CurrentSeqAlign = salp;
/* calculate and save alignment profile */
if (!AlnMgrIndexSeqAlign(salp))
ERR_RETURN_VAL("problem indexing SeqAlign", FALSE);
if (AlnMgrGetAlnLength(salp, FALSE) <= 0)
return TRUE;
if (!(app = ACT_MakeProfileFromSA(salp)))
ERR_RETURN_VAL("problem generating sequence profile", FALSE);
if (CSC_CurrentProfile) ACT_ProfileSetFree(CSC_CurrentProfile);
CSC_CurrentProfile = app;
/* allocate/free new color storage as necessary */
for (len = 0, app = CSC_CurrentProfile; app; app = app->next) len += app->len;
if (len != AlnMgrGetAlnLength(salp, FALSE)) /* sanity check */
ERR_RETURN_VAL("length mismatch between alignment and profile", FALSE);
if (len != CSC_CurrentNColumns) {
if (CSC_CurrentColors)
MemFree(CSC_CurrentColors);
CSC_CurrentColors = (Nlm_Uchar *) MemNew(3 * len * sizeof(Nlm_Uchar));
if (!CSC_CurrentColors)
ERR_RETURN_VAL("out of memory", FALSE);
CSC_CurrentNColumns = len;
}
/* do the appropriate calculation */
CSC_CurrentProfileRows = CSC_CurrentProfile->nuc ? 5 : 25;
(*CSC_AlgorithmFuncList[CSC_CurrentAlgorithm].function)();
return TRUE;
}
/* determine whether a (view) row has a structure */
static Nlm_Boolean CSC_DoesRowHaveStructure(Nlm_Int4 row, PMSD pmsd)
{
PDNMM pdnmm;
PDNMS pdnms;
/* convert viewed row that's passed into target row to search MMD's*/
row = ViewMgr_VRow2TRow(CSC_CurrentSeqAlign, row);
/* check master */
pdnmm = pmsd->pdnmmHead;
while (pdnmm) {
if (((PMMD) pdnmm->data.ptrvalue)->iTargetRow == row)
return TRUE;
pdnmm = pdnmm->next;
}
/* go through the slave structures */
pdnms = pmsd->pdnmsSlaves;
while (pdnms) {
pdnmm = ((PMSD) pdnms->data.ptrvalue)->pdnmmHead;
while (pdnmm) {
if (((PMMD) pdnmm->data.ptrvalue)->iTargetRow == row)
return TRUE;
pdnmm = pdnmm->next;
}
pdnms = pdnms->next;
}
return FALSE;
}
/* color a row */
void CSC_SetDDVRowCells(Nlm_Int4 row, Nlm_Boolean applyColumnColor,
Nlm_Uint1 *unalignedColor, DDV_ColorGlobal *pDDVCG)
{
BioseqPtr bsp;
int seqLoc;
DDV_ColorCell *pColorCell;
Nlm_Int4 alignLoc, residueColorInt;
Nlm_Uint1 residueColor[3];
if (row <= 0 || !pDDVCG || !CSC_CurrentSeqAlign)
return;
bsp = BioseqLockById(AlnMgrGetNthSeqIdPtr(CSC_CurrentSeqAlign, row));
if (!bsp) return;
for (seqLoc = 0; seqLoc < bsp->length; seqLoc++) {
pColorCell = DDV_GetColor(pDDVCG, NULL, row, seqLoc);
if (pColorCell == NULL) return;
alignLoc = AlnMgrMapBioseqToSeqAlign(CSC_CurrentSeqAlign, seqLoc, row, NULL);
if (alignLoc >= 0 && applyColumnColor) {
residueColorInt = CSC_GetColumnColorByRow(row, seqLoc);
residueColor[0] = (residueColorInt >> 16) & 0xFF;
residueColor[1] = (residueColorInt >> 8) & 0xFF;
residueColor[2] = residueColorInt & 0xFF;
DDV_SetColorInCell(pColorCell, residueColor);
} else {
DDV_SetColorInCell(pColorCell, unalignedColor);
}
DDV_RequestColor(&(pDDVCG->Palette), pColorCell);
pColorCell->LowerCase = (alignLoc < 0);
DDV_SetColor(pDDVCG, NULL, row, seqLoc, pColorCell);
}
BioseqUnlock(bsp);
}
/* color non-structure rows */
void CSC_SetNonStructureDDVRowCells(PMSD pmsd, Nlm_Boolean applyColumnColor,
Nlm_Uint1 *unalignedColor, DDV_ColorGlobal *pDDVCG)
{
int row, nRows;
if (!pmsd || !pDDVCG || !CSC_CurrentSeqAlign)
return;
nRows = AlnMgrGetNumRows(CSC_CurrentSeqAlign);
for (row = 1; row <= nRows; row++) {
if (!CSC_DoesRowHaveStructure(row, pmsd))
CSC_SetDDVRowCells(row, applyColumnColor, unalignedColor, pDDVCG);
}
}
/* do all rows */
void CSC_SetAllDDVRowCells(Nlm_Boolean applyColumnColor, Nlm_Uint1 *unalignedColor,
DDV_ColorGlobal *pDDVCG)
{
int row, nRows;
if (!pDDVCG || !CSC_CurrentSeqAlign)
return;
nRows = AlnMgrGetNumRows(CSC_CurrentSeqAlign);
for (row = 1; row <= nRows; row++)
CSC_SetDDVRowCells(row, applyColumnColor, unalignedColor, pDDVCG);
}
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