int main(int argc, char *argv[])
{
embInitPV("gseqinfo", argc, argv, "GEMBASSY", "1.0.3");
AjPSeqall seqall;
AjPSeq seq;
AjPStr inseq = NULL;
AjPStr ori = NULL;
AjPStr ter = NULL;
AjPStr restid = NULL;
AjPStr seqid = NULL;
AjPStr base = NULL;
AjPStr url = NULL;
AjPStr tmpname = NULL;
AjPSeqout tmpout = NULL;
AjPFile outf = NULL;
seqall = ajAcdGetSeqall("sequence");
outf = ajAcdGetOutfile("outfile");
base = ajStrNewC("rest.g-language.org");
gAssignUniqueName(&tmpname);
ajStrAppendC(&tmpname, ".fasta");
while(ajSeqallNext(seqall, &seq))
{
tmpout = ajSeqoutNew();
if(!ajSeqoutOpenFilename(tmpout, tmpname))
{
embExitBad();
}
ajSeqoutSetFormatS(tmpout,ajStrNewC("fasta"));
ajSeqoutWriteSeq(tmpout, seq);
ajSeqoutClose(tmpout);
ajSeqoutDel(&tmpout);
ajFmtPrintS(&url, "http://%S/upload/upl.pl", base);
gFilePostSS(url, tmpname, &restid);
ajStrDel(&url);
ajSysFileUnlinkS(tmpname);
ajStrAssignS(&seqid, ajSeqGetAccS(seq));
if(ajStrGetLen(seqid) == 0)
{
ajStrAssignS(&seqid, ajSeqGetNameS(seq));
}
if(ajStrGetLen(seqid) == 0)
{
ajWarn("No valid header information\n");
}
url = ajStrNew();
ajFmtPrintS(&url, "http://%S/%S/seqinfo/", base, restid);
ajFmtPrintF(outf, "Sequence: %S\n", seqid);
if(!gFileOutURLS(url, &outf))
{
ajDie("Failed to download result from:\n%S\n", url);
}
ajStrDel(&url);
ajStrDel(&restid);
ajStrDel(&seqid);
ajStrDel(&inseq);
}
ajFileClose(&outf);
ajSeqallDel(&seqall);
ajSeqDel(&seq);
ajStrDel(&base);
embExit();
return 0;
}
int main(int argc, char **argv) {
embInitPV("kpsort", argc, argv, "KBWS", "1.0.8");
AjPSeqall seqall;
AjPSeq seq;
AjPFile outf;
AjPStr substr;
AjPStr org;
AjPStr title;
struct soap soap;
struct ns1__psortInputParams params;
org = ajAcdGetString("org");
title = ajAcdGetString("title");
params.org = ajCharNewS(org);
params.title = ajCharNewS(title);
char* jobid;
char* result;
seqall = ajAcdGetSeqall("seqall");
outf = ajAcdGetOutfile("outfile");
while(ajSeqallNext(seqall, &seq)) {
soap_init(&soap);
char* in0;
in0 = ajSeqGetSeqCopyC(seq);
//ajSeqGetNameC(seq);
if(soap_call_ns1__runPsort( &soap, NULL, NULL, in0, ¶ms, &jobid )== SOAP_OK) {
fprintf(stderr,"Jobid: %s\n",jobid);
} else {
soap_print_fault(&soap, stderr);
}
int check = 0;
while (check == 0) {
if(soap_call_ns1__checkStatus( &soap, NULL, NULL, jobid, &check )== SOAP_OK) {
fprintf(stderr,"*");
} else {
soap_print_fault(&soap, stderr);
}
sleep(3);
}
fprintf(stderr,"\n");
if(soap_call_ns1__getResult( &soap, NULL, NULL, jobid, &result )== SOAP_OK) {
substr = ajStrNewC(result);
ajFmtPrintF(outf,"%S\n",substr);
} else {
soap_print_fault(&soap, stderr);
}
soap_destroy(&soap);
soap_end(&soap);
soap_done(&soap);
}
ajFileClose(&outf);
ajSeqallDel(&seqall);
ajSeqDel(&seq);
ajStrDel(&substr);
embExit();
return 0;
}
int main(int argc, char **argv)
{
AjPSeqall seqall;
AjPSeq seq = NULL;
AjPStr seqcmp = NULL;
AjPStr enzymes = NULL;
AjPFile outf = NULL;
ajint begin;
ajint end;
ajint min;
ajint max;
ajint sitelen;
AjBool alpha;
AjBool single;
AjBool blunt;
AjBool ambiguity;
AjBool sticky;
AjBool plasmid;
AjBool threeprime;
AjBool commercial;
AjBool html;
AjBool limit;
AjBool frags;
AjBool methyl;
AjPFile dfile;
AjPFile enzfile = NULL;
AjPFile equfile = NULL;
AjPFile methfile = NULL;
AjPStr name = NULL;
AjPTable table = NULL;
ajint hits;
AjPList l = NULL;
embInit("restover", argc, argv);
seqall = ajAcdGetSeqall("sequence");
seqcmp = ajAcdGetString("seqcomp");
ajStrFmtUpper(&seqcmp);
outf = ajAcdGetOutfile("outfile");
/*
** Some of these are not needed but I left them in case someone wants to
** use them some time ...
*/
enzymes = ajStrNewC("all");
min = ajAcdGetInt("min");
max = ajAcdGetInt("max");
sitelen = 2;
threeprime = ajAcdGetBoolean("threeprime");
blunt = ajAcdGetBoolean("blunt");
sticky = ajAcdGetBoolean("sticky");
single = ajAcdGetBoolean("single");
html = ajAcdGetBoolean("html");
alpha = ajAcdGetBoolean("alphabetic");
ambiguity = ajAcdGetBoolean("ambiguity");
plasmid = ajAcdGetBoolean("plasmid");
commercial = ajAcdGetBoolean("commercial");
limit = ajAcdGetBoolean("limit");
frags = ajAcdGetBoolean("fragments");
methyl = ajAcdGetBoolean("methylation");
dfile = ajAcdGetDatafile("datafile");
methfile = ajAcdGetDatafile("mfile");
if(single)
max = min = 1;
table = ajTablestrNew(EQUGUESS);
l = ajListNew();
if(threeprime)
ajStrReverse(&seqcmp);
/* read the local file of enzymes names */
restover_read_file_of_enzyme_names(&enzymes);
if(!dfile)
{
enzfile = ajDatafileNewInNameC(ENZDATA);
if(!enzfile)
ajFatal("Cannot locate enzyme file. Run REBASEEXTRACT");
}
else
{
enzfile = dfile;
}
if(limit)
{
equfile = ajDatafileNewInNameC(EQUDATA);
if(!equfile)
limit=ajFalse;
else
{
restover_read_equiv(equfile,table);
ajFileClose(&equfile);
}
}
while(ajSeqallNext(seqall, &seq))
{
begin = ajSeqallGetseqBegin(seqall);
end = ajSeqallGetseqEnd(seqall);
ajFileSeek(enzfile,0L,0);
ajSeqFmtUpper(seq);
hits = embPatRestrictMatch(seq,begin,end,enzfile,methfile,enzymes,
sitelen,plasmid,ambiguity,min,max,blunt,
sticky,commercial,methyl,l);
ajDebug("hits:%d listlen:%u\n", hits, ajListGetLength(l));
if(hits)
{
name = ajStrNewC(ajSeqGetNameC(seq));
restover_printHits(seq, seqcmp, outf,l,name,hits,begin,end,
min,max,plasmid,
sitelen,limit,table,alpha,frags,
html);
ajStrDel(&name);
}
ajListFree(&l);
}
ajListFree(&l);
ajSeqDel(&seq);
ajFileClose(&outf);
ajFileClose(&dfile);
ajFileClose(&enzfile);
ajFileClose(&equfile);
ajFileClose(&methfile);
ajSeqallDel(&seqall);
ajStrDel(&seqcmp);
ajStrDel(&enzymes);
ajStrDel(&name);
ajTablestrFree(&table);
embExit();
return 0;
}
int main(int argc, char **argv)
{
AjPSeqall seqall;
AjPSeqout seqout;
AjPSeq seq = NULL;
AjPStr str = NULL;
AjPStr desc = NULL;
ajint tail3;
ajint tail5 = 0;
ajint minlength;
ajint mismatches;
AjBool reverse;
AjBool fiveprime;
AjBool cvttolower;
embInit("trimest", argc, argv);
seqall = ajAcdGetSeqall("sequence");
seqout = ajAcdGetSeqoutall("outseq");
minlength = ajAcdGetInt("minlength");
mismatches = ajAcdGetInt("mismatches");
reverse = ajAcdGetBoolean("reverse");
fiveprime = ajAcdGetBoolean("fiveprime");
cvttolower = ajAcdGetToggle("tolower");
str = ajStrNew();
while(ajSeqallNext(seqall, &seq))
{
/* get sequence description */
ajStrAssignS(&desc, ajSeqGetDescS(seq));
/* get positions to cut in 5' poly-T and 3' poly-A tails */
if(fiveprime)
tail5 = trimest_get_tail(seq, 5, minlength, mismatches);
tail3 = trimest_get_tail(seq, 3, minlength, mismatches);
/* get a COPY of the sequence string */
ajStrAssignS(&str, ajSeqGetSeqS(seq));
/* cut off longest of 3' or 5' tail */
if(tail5 > tail3)
{
/* if 5' poly-T tail, then reverse the sequence */
ajDebug("Tail=%d\n", tail5);
if(cvttolower)
trimest_tolower(&str, 0, tail5-1);
else
ajStrKeepRange(&str, tail5, ajSeqGetLen(seq)-1);
ajStrAppendC(&desc, " [poly-T tail removed]");
}
else if(tail3 > tail5)
{
/* remove 3' poly-A tail */
ajDebug("Tail=%d\n", tail3);
if(cvttolower)
trimest_tolower(&str, ajSeqGetLen(seq)-tail3,
ajSeqGetLen(seq));
else
ajStrKeepRange(&str, 0, ajSeqGetLen(seq)-tail3-1);
ajStrAppendC(&desc, " [poly-A tail removed]");
}
/* write sequence out */
ajSeqAssignSeqS(seq, str);
/* reverse complement if poly-T found */
if(tail5 > tail3 && reverse)
{
ajSeqReverseForce(seq);
ajStrAppendC(&desc, " [reverse complement]");
}
/* set description */
ajSeqAssignDescS(seq, desc);
ajSeqoutWriteSeq(seqout, seq);
}
ajSeqoutClose(seqout);
ajStrDel(&str);
ajStrDel(&desc);
ajSeqallDel(&seqall);
ajSeqDel(&seq);
ajSeqoutDel(&seqout);
embExit();
return 0;
}
int main(int argc, char *argv[])
{
embInitPV("gbui", argc, argv, "GEMBASSY", "1.0.1");
AjPSeqall seqall;
AjPSeq seq;
AjPStr inseq = NULL;
AjBool translate = ajFalse;
AjPStr position = NULL;
AjPStr delkey = NULL;
AjBool accid = ajFalse;
AjPStr restid = NULL;
AjPStr seqid = NULL;
AjPStr base = NULL;
AjPStr url = NULL;
AjPFile tmpfile = NULL;
AjPStr tmpname = NULL;
AjPFile outf = NULL;
seqall = ajAcdGetSeqall("sequence");
translate = ajAcdGetBoolean("translate");
position = ajAcdGetListSingle("position");
delkey = ajAcdGetString("delkey");
accid = ajAcdGetBoolean("accid");
outf = ajAcdGetOutfile("outfile");
if(ajStrMatchC(position, "all"))
{
ajStrDel(&position);
position = ajStrNew();
}
base = ajStrNewC("rest.g-language.org");
gAssignUniqueName(&tmpname);
while(ajSeqallNext(seqall, &seq))
{
inseq = NULL;
if(!accid)
{
if(gFormatGenbank(seq, &inseq))
{
tmpfile = ajFileNewOutNameS(tmpname);
if(!tmpfile)
{
ajDie("Output file (%S) open error\n", tmpname);
}
ajFmtPrintF(tmpfile, "%S", inseq);
ajFileClose(&tmpfile);
ajFmtPrintS(&url, "http://%S/upload/upl.pl", base);
gFilePostSS(url, tmpname, &restid);
ajStrDel(&url);
ajSysFileUnlinkS(tmpname);
}
else
{
ajDie("Sequence does not have features\n"
"Proceeding with sequence accession ID\n");
accid = ajTrue;
}
}
if(accid)
{
ajStrAssignS(&restid, ajSeqGetAccS(seq));
if(!ajStrGetLen(restid))
{
ajStrAssignS(&restid, ajSeqGetNameS(seq));
}
if(!ajStrGetLen(restid))
{
ajDie("No valid header information\n");
}
}
ajStrAssignS(&seqid, ajSeqGetAccS(seq));
url = ajStrNew();
ajFmtPrintS(&url, "http://%S/%S/bui/translate=%d/position=%S/"
"delkey=%S/output=f/tag=gene", base, restid, translate,
position, delkey);
ajFmtPrintF(outf, "Sequence: %S\n", seqid);
if(!gFileOutURLS(url, &outf))
{
ajDie("Failed to download result from:\n%S\n", url);
}
ajStrDel(&url);
ajStrDel(&inseq);
}
ajFileClose(&outf);
ajSeqallDel(&seqall);
ajSeqDel(&seq);
ajStrDel(&seqid);
ajStrDel(&position);
ajStrDel(&delkey);
embExit();
return 0;
}
int main(int argc, char **argv)
{
AjPSeqall seqall;
AjPFile primfile;
AjPStr rdline = NULL;
Primer primdata;
AjPStrTok handle = NULL;
AjPList primList = NULL;
embInit("stssearch", argc, argv);
primfile = ajAcdGetInfile("infile");
out = ajAcdGetOutfile("outfile");
seqall = ajAcdGetSeqall("seqall");
while(ajReadlineTrim(primfile, &rdline))
{
if(ajStrGetCharFirst(rdline) == '#')
continue;
if(ajStrSuffixC(rdline, ".."))
continue;
AJNEW(primdata);
primdata->Name = NULL;
primdata->Oligoa = NULL;
primdata->Oligob = NULL;
handle = ajStrTokenNewC(rdline, " \t");
ajStrTokenNextParse(&handle, &primdata->Name);
if(!(nprimers % 1000))
ajDebug("Name [%d]: '%S'\n", nprimers, primdata->Name);
ajStrTokenNextParse(&handle, &primdata->Oligoa);
ajStrFmtUpper(&primdata->Oligoa);
primdata->Prima = ajRegComp(primdata->Oligoa);
ajStrTokenNextParse(&handle, &primdata->Oligob);
ajStrFmtUpper(&primdata->Oligob);
primdata->Primb = ajRegComp(primdata->Oligob);
ajStrTokenDel(&handle);
if(!nprimers)
primList = ajListNew();
ajListPushAppend(primList, primdata);
nprimers++;
}
if(!nprimers)
ajFatal("No primers read\n");
ajDebug("%d primers read\n", nprimers);
while(ajSeqallNext(seqall, &seq))
{
ajSeqFmtUpper(seq);
ajStrAssignS(&seqstr, ajSeqGetSeqS(seq));
ajStrAssignS(&revstr, ajSeqGetSeqS(seq));
ajSeqstrReverse(&revstr);
ajDebug("Testing: %s\n", ajSeqGetNameC(seq));
ntests = 0;
ajListMap(primList, stssearch_primTest, NULL);
}
ajFileClose(&out);
ajSeqallDel(&seqall);
ajSeqDel(&seq);
ajFileClose(&out);
ajStrDel(&revstr);
ajStrDel(&seqstr);
ajFileClose(&primfile);
ajListMap(primList, stssearch_primDel, NULL);
ajListFree(&primList);
ajStrDel(&rdline);
embExit();
return 0;
}
int main(int argc, char **argv)
{
/* Global details */
AjBool explain_flag;
AjBool file_flag;
AjPStr* task;
AjBool do_primer;
AjBool do_hybrid;
ajint num_return;
ajint first_base_index;
/* "Sequence" Input Tags */
AjPSeqall sequence;
AjPRange included_region;
AjPRange target;
AjPRange excluded_region;
AjPStr left_input;
AjPStr right_input;
/* Primer details */
AjBool pick_anyway;
AjPFile mispriming_library;
float max_mispriming;
float pair_max_mispriming;
ajint gc_clamp;
ajint opt_size;
ajint min_size;
ajint max_size;
float opt_tm;
float min_tm;
float max_tm;
float max_diff_tm;
float opt_gc_percent;
float min_gc;
float max_gc;
float salt_conc;
float dna_conc;
ajint num_ns_accepted;
float self_any;
float self_end;
ajint max_poly_x;
/* Sequence Quality. These are not (yet) implemented */
/*
AjPFile sequence_quality;
ajint min_quality;
ajint min_end_quality;
ajint quality_range_min;
ajint quality_range_max;
*/
/* Product details */
ajint product_opt_size;
AjPRange product_size_range;
float product_opt_tm;
float product_min_tm;
float product_max_tm;
/* Objective Function Penalty Weights for Primers */
float max_end_stability;
/* these are not (yet) implemented */
/*
float inside_penalty;
float outside_penalty;
*/
/* Primer penalties */
/* these are not (yet) implemented */
/* Internal Oligo "Sequence" Input Tags */
AjPRange internal_oligo_excluded_region;
/* Internal Oligo "Global" Input Tags */
AjPStr internal_oligo_input;
ajint internal_oligo_opt_size;
ajint internal_oligo_min_size;
ajint internal_oligo_max_size;
float internal_oligo_opt_tm;
float internal_oligo_min_tm;
float internal_oligo_max_tm;
float internal_oligo_opt_gc_percent;
float internal_oligo_min_gc;
float internal_oligo_max_gc;
float internal_oligo_salt_conc;
float internal_oligo_dna_conc;
float internal_oligo_self_any;
float internal_oligo_self_end;
ajint internal_oligo_max_poly_x;
AjPFile internal_oligo_mishyb_library;
float internal_oligo_max_mishyb;
/*
ajint internal_oligo_min_quality;
*/
/* Internal Oligo penalties */
/* these are not (yet) implemented */
/* EMBOSS-wrapper-specific stuff */
AjPFile outfile;
/* other variables */
AjPStr result = NULL;
AjPStr strand = NULL;
AjPStr substr = NULL;
AjPSeq seq = NULL;
ajint begin = 0;
ajint end;
FILE* stream;
AjPStr taskstr = NULL;
const AjPStr program = NULL;
/* pipe variables */
int *pipeto; /* pipe to feed the exec'ed program input */
int *pipefrom; /* pipe to get the exec'ed program output */
embInit("eprimer3", argc, argv);
/* Global details */
explain_flag = ajAcdGetBoolean("explainflag");
file_flag = ajAcdGetBoolean("fileflag");
task = ajAcdGetList("task");
do_primer = ajAcdGetToggle("primer");
do_hybrid = ajAcdGetToggle("hybridprobe");
num_return = ajAcdGetInt("numreturn");
first_base_index = ajAcdGetInt("firstbaseindex");
/* "Sequence" Input Tags */
sequence = ajAcdGetSeqall("sequence");
included_region = ajAcdGetRange("includedregion");
target = ajAcdGetRange("targetregion");
excluded_region = ajAcdGetRange("excludedregion");
left_input = ajAcdGetString("forwardinput");
right_input = ajAcdGetString("reverseinput");
/* Primer details */
pick_anyway = ajAcdGetBoolean("pickanyway");
mispriming_library = ajAcdGetInfile("mispriminglibraryfile");
max_mispriming = ajAcdGetFloat("maxmispriming");
pair_max_mispriming = ajAcdGetFloat("pairmaxmispriming");
gc_clamp = ajAcdGetInt("gcclamp");
opt_size = ajAcdGetInt("osize");
min_size = ajAcdGetInt("minsize");
max_size = ajAcdGetInt("maxsize");
opt_tm = ajAcdGetFloat("otm");
min_tm = ajAcdGetFloat("mintm");
max_tm = ajAcdGetFloat("maxtm");
max_diff_tm = ajAcdGetFloat("maxdifftm");
opt_gc_percent = ajAcdGetFloat("ogcpercent");
min_gc = ajAcdGetFloat("mingc");
max_gc = ajAcdGetFloat("maxgc");
salt_conc = ajAcdGetFloat("saltconc");
dna_conc = ajAcdGetFloat("dnaconc");
num_ns_accepted = ajAcdGetInt("numnsaccepted");
self_any = ajAcdGetFloat("selfany");
self_end = ajAcdGetFloat("selfend");
max_poly_x = ajAcdGetInt("maxpolyx");
AJCNEW0(pipeto,2);
AJCNEW0(pipefrom,2);
/* Sequence Quality */
/* these are not (yet) implemented */
/*
sequence_quality = ajAcdGetInfile("sequencequality");
min_quality = ajAcdGetInt("minquality");
min_end_quality = ajAcdGetInt("minendquality");
quality_range_min = ajAcdGetInt("qualityrangemin");
quality_range_max = ajAcdGetInt("qualityrangemax");
*/
/* Product details */
product_opt_size = ajAcdGetInt("psizeopt");
product_size_range = ajAcdGetRange("prange");
product_opt_tm = ajAcdGetFloat("ptmopt");
product_min_tm = ajAcdGetFloat("ptmmin");
product_max_tm = ajAcdGetFloat("ptmmax");
/* Objective Function Penalty Weights for Primers */
max_end_stability = ajAcdGetFloat("maxendstability");
/* these are not (yet) implemented */
/*
inside_penalty = ajAcdGetFloat("insidepenalty");
outside_penalty = ajAcdGetFloat("outsidepenalty");
*/
/* Primer penalties */
/* these are not (yet) implemented */
/* Internal Oligo "Sequence" Input Tags */
internal_oligo_excluded_region = ajAcdGetRange("oexcludedregion");
internal_oligo_input = ajAcdGetString("oligoinput");
/* Internal Oligo "Global" Input Tags */
internal_oligo_opt_size = ajAcdGetInt("osizeopt");
internal_oligo_min_size = ajAcdGetInt("ominsize");
internal_oligo_max_size = ajAcdGetInt("omaxsize");
internal_oligo_opt_tm = ajAcdGetFloat("otmopt");
internal_oligo_min_tm = ajAcdGetFloat("otmmin");
internal_oligo_max_tm = ajAcdGetFloat("otmmax");
internal_oligo_opt_gc_percent = ajAcdGetFloat("ogcopt");
internal_oligo_min_gc = ajAcdGetFloat("ogcmin");
internal_oligo_max_gc = ajAcdGetFloat("ogcmax");
internal_oligo_salt_conc = ajAcdGetFloat("osaltconc");
internal_oligo_dna_conc = ajAcdGetFloat("odnaconc");
internal_oligo_self_any = ajAcdGetFloat("oanyself");
internal_oligo_self_end = ajAcdGetFloat("oendself");
internal_oligo_max_poly_x = ajAcdGetInt("opolyxmax");
internal_oligo_mishyb_library = ajAcdGetInfile("mishyblibraryfile");
internal_oligo_max_mishyb = ajAcdGetFloat("omishybmax");
/*
internal_oligo_min_quality = ajAcdGetInt("oligominquality");
*/
/* Internal Oligo penalties */
/* these are not (yet) implemented */
/* EMBOSS-wrapper-specific stuff */
outfile = ajAcdGetOutfile("outfile");
ajStrRemoveWhite(&left_input);
ajStrRemoveWhite(&right_input);
/*
** OK - we will now try to do a separate fork-exec for each sequence.
*/
result = ajStrNew();
while(ajSeqallNext(sequence, &seq))
{
program = ajAcdGetpathC("primer3_core");
if(!ajSysExecRedirectC(ajStrGetPtr(program),&pipeto,&pipefrom))
ajFatal("eprimer3: Could not exec primer3_core");
stream = eprimer3_start_write(pipeto[1]);
/* send primer3 Primer "Global" parameters */
eprimer3_send_bool(stream, "PRIMER_EXPLAIN_FLAG", explain_flag);
eprimer3_send_bool(stream, "PRIMER_FILE_FLAG", file_flag);
if(do_hybrid)
{
if(!ajStrCmpC(task[0], "1"))
ajStrAssignC(&taskstr, "pick_pcr_primers_and_hyb_probe");
else if(!ajStrCmpC(task[0], "2"))
ajStrAssignC(&taskstr, "pick_left_only");
else if(!ajStrCmpC(task[0], "3"))
ajStrAssignC(&taskstr, "pick_right_only");
else if(!ajStrCmpC(task[0], "4"))
ajStrAssignC(&taskstr, "pick_hyb_probe_only");
if (!do_primer)
ajStrAssignC(&taskstr, "pick_hyb_probe_only");
}
else
{
if(!ajStrCmpC(task[0], "1"))
ajStrAssignC(&taskstr, "pick_pcr_primers");
else if(!ajStrCmpC(task[0], "2"))
ajStrAssignC(&taskstr, "pick_left_only");
else if(!ajStrCmpC(task[0], "3"))
ajStrAssignC(&taskstr, "pick_right_only");
else if(!ajStrCmpC(task[0], "4"))
ajStrAssignC(&taskstr, "pick_hyb_probe_only");
}
eprimer3_send_string(stream, "PRIMER_TASK", taskstr);
eprimer3_send_int(stream, "PRIMER_NUM_RETURN", num_return);
eprimer3_send_int(stream, "PRIMER_FIRST_BASE_INDEX",
first_base_index);
eprimer3_send_bool(stream, "PRIMER_PICK_ANYWAY", pick_anyway);
/* mispriming library may not have been specified */
if(mispriming_library)
eprimer3_send_stringC(stream, "PRIMER_MISPRIMING_LIBRARY",
ajFileGetPrintnameC(mispriming_library));
eprimer3_send_float(stream, "PRIMER_MAX_MISPRIMING",
max_mispriming);
eprimer3_send_float(stream, "PRIMER_PAIR_MAX_MISPRIMING",
pair_max_mispriming);
eprimer3_send_int(stream, "PRIMER_GC_CLAMP", gc_clamp);
eprimer3_send_int(stream, "PRIMER_OPT_SIZE", opt_size);
eprimer3_send_int(stream, "PRIMER_MIN_SIZE", min_size);
eprimer3_send_int(stream, "PRIMER_MAX_SIZE", max_size);
eprimer3_send_float(stream, "PRIMER_OPT_TM", opt_tm);
eprimer3_send_float(stream, "PRIMER_MIN_TM", min_tm);
eprimer3_send_float(stream, "PRIMER_MAX_TM", max_tm);
eprimer3_send_float(stream, "PRIMER_MAX_DIFF_TM", max_diff_tm);
eprimer3_send_float(stream, "PRIMER_OPT_GC_PERCENT",
opt_gc_percent);
eprimer3_send_float(stream, "PRIMER_MIN_GC", min_gc);
eprimer3_send_float(stream, "PRIMER_MAX_GC", max_gc);
eprimer3_send_float(stream, "PRIMER_SALT_CONC", salt_conc);
eprimer3_send_float(stream, "PRIMER_DNA_CONC", dna_conc);
eprimer3_send_int(stream, "PRIMER_NUM_NS_ACCEPTED",
num_ns_accepted);
eprimer3_send_float(stream, "PRIMER_SELF_ANY", self_any);
eprimer3_send_float(stream, "PRIMER_SELF_END", self_end);
eprimer3_send_int(stream, "PRIMER_MAX_POLY_X", max_poly_x);
eprimer3_send_int(stream, "PRIMER_PRODUCT_OPT_SIZE",
product_opt_size);
eprimer3_send_range2(stream, "PRIMER_PRODUCT_SIZE_RANGE",
product_size_range);
eprimer3_send_float(stream, "PRIMER_PRODUCT_OPT_TM",
product_opt_tm);
eprimer3_send_float(stream, "PRIMER_PRODUCT_MIN_TM",
product_min_tm);
eprimer3_send_float(stream, "PRIMER_PRODUCT_MAX_TM",
product_max_tm);
eprimer3_send_float(stream, "PRIMER_MAX_END_STABILITY",
max_end_stability);
/* send primer3 Internal Oligo "Global" parameters */
eprimer3_send_int(stream, "PRIMER_INTERNAL_OLIGO_OPT_SIZE",
internal_oligo_opt_size);
eprimer3_send_int(stream, "PRIMER_INTERNAL_OLIGO_MIN_SIZE",
internal_oligo_min_size);
eprimer3_send_int(stream, "PRIMER_INTERNAL_OLIGO_MAX_SIZE",
internal_oligo_max_size);
eprimer3_send_float(stream, "PRIMER_INTERNAL_OLIGO_OPT_TM",
internal_oligo_opt_tm);
eprimer3_send_float(stream, "PRIMER_INTERNAL_OLIGO_MIN_TM",
internal_oligo_min_tm);
eprimer3_send_float(stream, "PRIMER_INTERNAL_OLIGO_MAX_TM",
internal_oligo_max_tm);
eprimer3_send_float(stream, "PRIMER_INTERNAL_OLIGO_OPT_GC_PERCENT",
internal_oligo_opt_gc_percent);
eprimer3_send_float(stream, "PRIMER_INTERNAL_OLIGO_MIN_GC",
internal_oligo_min_gc);
eprimer3_send_float(stream, "PRIMER_INTERNAL_OLIGO_MAX_GC",
internal_oligo_max_gc);
eprimer3_send_float(stream, "PRIMER_INTERNAL_OLIGO_SALT_CONC",
internal_oligo_salt_conc);
eprimer3_send_float(stream, "PRIMER_INTERNAL_OLIGO_DNA_CONC",
internal_oligo_dna_conc);
eprimer3_send_float(stream, "PRIMER_INTERNAL_OLIGO_SELF_ANY",
internal_oligo_self_any);
eprimer3_send_float(stream, "PRIMER_INTERNAL_OLIGO_SELF_END",
internal_oligo_self_end);
eprimer3_send_int(stream, "PRIMER_INTERNAL_OLIGO_MAX_POLY_X",
internal_oligo_max_poly_x);
/*
** internal oligo mishybridising library may not have been
** specified
*/
if(internal_oligo_mishyb_library)
eprimer3_send_stringC(stream,
"PRIMER_INTERNAL_OLIGO_MISHYB_LIBRARY",
ajFileGetPrintnameC(internal_oligo_mishyb_library));
eprimer3_send_float(stream, "PRIMER_INTERNAL_OLIGO_MAX_MISHYB",
internal_oligo_max_mishyb);
/*
** Start sequence-specific stuff
*/
begin = ajSeqallGetseqBegin(sequence) - 1;
end = ajSeqallGetseqEnd(sequence) - 1;
strand = ajSeqGetSeqCopyS(seq);
ajStrFmtUpper(&strand);
ajStrAssignSubC(&substr,ajStrGetPtr(strand), begin, end);
/* send flags to turn on using optimal product size */
eprimer3_send_float(stream, "PRIMER_PAIR_WT_PRODUCT_SIZE_GT",
(float)0.05);
eprimer3_send_float(stream, "PRIMER_PAIR_WT_PRODUCT_SIZE_LT",
(float)0.05);
/* send primer3 Primer "Sequence" parameters */
eprimer3_send_string(stream, "SEQUENCE", substr);
/* if no ID name, use the USA */
if(ajStrMatchC(ajSeqGetNameS(seq),""))
eprimer3_send_string(stream, "PRIMER_SEQUENCE_ID",
ajSeqGetUsaS(seq));
else
eprimer3_send_string(stream, "PRIMER_SEQUENCE_ID",
ajSeqGetNameS(seq));
eprimer3_send_range(stream, "INCLUDED_REGION", included_region,
begin);
eprimer3_send_range(stream, "TARGET", target, begin);
eprimer3_send_range(stream, "EXCLUDED_REGION", excluded_region,
begin);
eprimer3_send_string(stream, "PRIMER_LEFT_INPUT", left_input);
eprimer3_send_string(stream, "PRIMER_RIGHT_INPUT", right_input);
/* send primer3 Internal Oligo "Sequence" parameters */
eprimer3_send_range(stream,
"PRIMER_INTERNAL_OLIGO_EXCLUDED_REGION",
internal_oligo_excluded_region, begin);
eprimer3_send_string(stream, "PRIMER_INTERNAL_OLIGO_INPUT",
internal_oligo_input);
/* end the primer3 input sequence record with a '=' */
eprimer3_send_end(stream);
/* and close the ouput pipe stream */
eprimer3_end_write(stream);
/* read the primer3 output */
eprimer3_read(pipefrom[0], &result);
eprimer3_report(outfile, result, num_return, begin);
ajStrSetClear(&result);
#ifndef WIN32
close(pipeto[1]);
close(pipefrom[0]);
#endif
} /* end of sequence loop */
ajStrDel(&result);
ajSeqDel(&seq);
ajStrDel(&strand);
ajStrDel(&substr);
ajFileClose(&outfile);
ajStrDel(&taskstr);
ajStrDelarray(&task);
ajSeqallDel(&sequence);
ajSeqDel(&seq);
ajRangeDel(&included_region);
ajRangeDel(&target);
ajRangeDel(&excluded_region);
ajRangeDel(&product_size_range);
ajRangeDel(&internal_oligo_excluded_region);
ajStrDel(&left_input);
ajStrDel(&right_input);
ajStrDel(&internal_oligo_input);
AJFREE(pipeto);
AJFREE(pipefrom);
ajFileClose(&mispriming_library);
embExit();
return 0;
}
int main(int argc, char *argv[])
{
embInitPV("greporiter", argc, argv, "GEMBASSY", "1.0.3");
AjPSeqall seqall;
AjPSeq seq;
AjPStr inseq = NULL;
AjBool accid = ajFalse;
AjPStr restid = NULL;
AjPStr seqid = NULL;
AjPStr base = NULL;
AjPStr url = NULL;
AjBool oriloc = 0;
AjBool gcskew = 0;
AjBool dbonly = 0;
ajint difthreshold = 0;
AjPFile outf = NULL;
AjPFile tmpfile = NULL;
AjPStr tmpname = NULL;
AjPStr fstname = NULL;
AjPFilebuff tmp = NULL;
AjPStr line = NULL;
AjPSeqout tmpout = NULL;
AjPRegexp regex;
AjPStr ori = NULL;
AjPStr ter = NULL;
seqall = ajAcdGetSeqall("sequence");
difthreshold = ajAcdGetInt("difthreshold");
oriloc = ajAcdGetBoolean("oriloc");
gcskew = ajAcdGetBoolean("gcskew");
dbonly = ajAcdGetBoolean("dbonly");
accid = ajAcdGetBoolean("accid");
outf = ajAcdGetOutfile("outfile");
base = ajStrNewC("rest.g-language.org");
gAssignUniqueName(&tmpname);
gAssignUniqueName(&fstname);
ajStrAppendC(&fstname, ".fasta");
while(ajSeqallNext(seqall, &seq))
{
inseq = ajStrNew();
tmpout = ajSeqoutNew();
if(!accid)
{
if(gFormatGenbank(seq, &inseq))
{
tmpfile = ajFileNewOutNameS(tmpname);
if(!tmpfile)
{
ajDie("Output file (%S) open error\n", tmpname);
}
ajFmtPrintF(tmpfile, "%S", inseq);
ajFileClose(&tmpfile);
ajFmtPrintS(&url, "http://%S/upload/upl.pl", base);
gFilePostSS(url, tmpname, &restid);
ajStrDel(&url);
ajSysFileUnlinkS(tmpname);
}
else
{
if(!ajSeqoutOpenFilename(tmpout, fstname))
{
embExitBad();
}
ajSeqoutSetFormatS(tmpout,ajStrNewC("fasta"));
ajSeqoutWriteSeq(tmpout, seq);
ajSeqoutClose(tmpout);
ajSeqoutDel(&tmpout);
ajFmtPrintS(&url, "http://%S/upload/upl.pl", base);
gFilePostSS(url, fstname, &restid);
ajStrDel(&url);
ajSysFileUnlinkS(fstname);
}
}
ajStrAssignS(&seqid, ajSeqGetAccS(seq));
if(ajStrGetLen(seqid) == 0)
{
ajStrAssignS(&seqid, ajSeqGetNameS(seq));
}
if(ajStrGetLen(seqid) == 0)
{
ajWarn("No valid header information\n");
}
if(accid)
{
ajStrAssignS(&restid, seqid);
if(ajStrGetLen(seqid) == 0)
{
ajDie("Cannot proceed without header with -accid\n");
}
if(!gValID(seqid))
{
ajDie("Invalid accession ID:%S, exiting\n", seqid);
}
}
url = ajStrNew();
ajFmtPrintS(&url, "http://%S/%S/rep_ori_ter/oriloc=%d/gcskew=%d/"
"difthreshold=%d/dbonly=%d/", base, restid, oriloc, gcskew,
difthreshold, dbonly);
if(!gFilebuffURLS(url, &tmp))
{
ajDie("Failed to download result from:\n%S\n", url);
}
ajBuffreadLine(tmp, &line);
regex = ajRegCompC("([0-9]+),([0-9]+)");
if(ajRegExec(regex, line)) {
if(ajRegSubI(regex, 1, &ori), ajRegSubI(regex, 2, &ter)) {
ajFmtPrint("%S Origin: %S Terminus %S\n", seqid, ori, ter);
}
}
ajStrDel(&url);
ajStrDel(&restid);
ajStrDel(&seqid);
ajStrDel(&inseq);
}
ajFileClose(&outf);
ajSeqallDel(&seqall);
ajSeqDel(&seq);
ajStrDel(&base);
embExit();
return 0;
}
int main(int argc, char **argv) {
// initialize EMBASSY info
embInitPV("kcentroidfold", argc, argv, "KBWS", "1.0.9");
// soap driver and parameter object
struct soap soap;
struct ns1__centroidfoldInputParams params;
char* jobid;
AjPSeqall seqall; // input sequence
AjPFile outf; // outfile
AjPStr goutfile; // graph file name
AjPFile goutf; // graph file handle
AjPSeq seq;
AjPStr inseq= NULL;
AjPStr substr;
AjPStr engine; // CONTRAfold, McCaskill, pfold or AUX
ajint gamma;
// get input/output info
seqall= ajAcdGetSeqall("seqall");
outf= ajAcdGetOutfile("outfile");
goutfile= ajAcdGetString("goutfile");
// get parameters
engine= ajAcdGetString("engine");
gamma= ajAcdGetInt("gamma");
// set parameters
params.model= ajCharNewS(engine);
params.gamma= gamma;
while (ajSeqallNext(seqall, &seq)) {
// initialize
soap_init(&soap);
inseq= NULL;
// convert sequence data to EMBOSS string as fasta format
ajStrAppendC(&inseq, ">");
ajStrAppendS(&inseq, ajSeqGetNameS(seq));
ajStrAppendC(&inseq, "\n");
ajStrAppendS(&inseq, ajSeqGetSeqS(seq));
// convert EMBOSS string to char* in C
char* in0;
in0= ajCharNewS(inseq);
// submit query via SOAP and get job ID
if (soap_call_ns1__runCentroidfold(&soap, NULL, NULL, in0, ¶ms, &jobid) == SOAP_OK) {
} else {
soap_print_fault(&soap, stderr);
}
// polling
int check = 0;
while (check == 0) {
if (soap_call_ns1__checkStatus(&soap, NULL, NULL, jobid, &check) == SOAP_OK) {
} else {
soap_print_fault(&soap, stderr);
}
sleep(3);
}
// get result (sequence alignment text data)
char* result;
if(soap_call_ns1__getMultiResult(&soap, NULL, NULL, jobid, "out", &result) == SOAP_OK) {
// convert result from C char* to EMBOSS string object
substr= ajStrNewC(result);
// output result (EMBOSS string) to file or STDOUT via EMBOSS
ajFmtPrintF(outf, "%S\n", substr);
} else {
soap_print_fault(&soap, stderr);
}
// get result (image file)
char* image_url;
if(soap_call_ns1__getMultiResult(&soap, NULL, NULL, jobid, "png", &image_url) == SOAP_OK) {
goutf= ajFileNewOutNameS(goutfile);
if (!goutf) {
// can not open image output file
ajFmtError("Problem writing out image file");
embExitBad();
}
if (!gHttpGetBinC(image_url, &goutf)) {
// can not download image file
ajFmtError("Problem downloading image file");
embExitBad();
}
} else {
soap_print_fault(&soap, stderr);
}
}
// destruct SOAP driver
soap_destroy(&soap);
soap_end(&soap);
soap_done(&soap);
// write output file and destruct outfile object
ajFileClose(&outf);
// destruct EMBOSS object
ajSeqallDel(&seqall);
ajSeqDel(&seq);
ajStrDel(&substr);
ajStrDel(&engine);
// exit
embExit();
return 0;
}
int main(int argc, char **argv)
{
AjPSeqall seqall;
AjPSeq seq = NULL;
AjPFile inf = NULL;
AjPStr strand = NULL;
AjPStr substr = NULL;
AjPStr name = NULL;
AjPStr mname = NULL;
AjPStr tname = NULL;
AjPStr pname = NULL;
AjPStr line = NULL;
AjPStr cons = NULL;
AjPStr m = NULL;
AjPStr n = NULL;
AjPAlign align= NULL; /* JISON, replaces AjPOutfile outf */
ajint type;
ajint begin;
ajint end;
ajulong len;
ajint i;
ajint j;
float **fmatrix=NULL;
ajint mlen;
float maxfs;
ajint thresh;
float gapopen;
float gapextend;
float opencoeff;
float extendcoeff;
const char *p;
ajulong maxarr = 1000;
ajulong alen;
float *path;
ajint *compass;
size_t stlen;
embInit("prophet", argc, argv);
seqall = ajAcdGetSeqall("sequence");
inf = ajAcdGetInfile("infile");
opencoeff = ajAcdGetFloat("gapopen");
extendcoeff = ajAcdGetFloat("gapextend");
align = ajAcdGetAlign("outfile"); /*JISON replacing outfile */
opencoeff = ajRoundFloat(opencoeff, 8);
extendcoeff = ajRoundFloat(extendcoeff, 8);
substr = ajStrNew();
name = ajStrNew();
mname = ajStrNew();
tname = ajStrNew();
line = ajStrNew();
m = ajStrNewC("");
n = ajStrNewC("");
type = prophet_getType(inf,&tname);
if(!type)
ajFatal("Unrecognised profile/matrix file format");
prophet_read_profile(inf,&pname,&mname,&mlen,&gapopen,&gapextend,&thresh,
&maxfs, &cons);
ajAlignSetMatrixName(align, mname);
AJCNEW(fmatrix, mlen);
for(i=0;i<mlen;++i)
{
AJCNEW(fmatrix[i], AZ);
if(!ajReadlineTrim(inf,&line))
ajFatal("Missing matrix line");
p = ajStrGetPtr(line);
p = ajSysFuncStrtok(p," \t");
for(j=0;j<AZ;++j)
{
sscanf(p,"%f",&fmatrix[i][j]);
p = ajSysFuncStrtok(NULL," \t");
}
}
AJCNEW(path, maxarr);
AJCNEW(compass, maxarr);
while(ajSeqallNext(seqall, &seq))
{
begin = ajSeqallGetseqBegin(seqall);
end = ajSeqallGetseqEnd(seqall);
ajStrAssignC(&name,ajSeqGetNameC(seq));
strand = ajSeqGetSeqCopyS(seq);
ajStrAssignSubC(&substr,ajStrGetPtr(strand),begin-1,end-1);
len = ajStrGetLen(substr);
if(len > (ULONG_MAX/(ajulong)(mlen+1)))
ajFatal("Sequences too big. Try 'supermatcher'");
alen = len*mlen;
if(alen>maxarr)
{
stlen = (size_t) alen;
AJCRESIZE(path,stlen);
AJCRESIZE(compass,stlen);
maxarr=alen;
}
ajStrAssignC(&m,"");
ajStrAssignC(&n,"");
/* JISON used to be
prophet_scan_profile(substr,pname,name,mlen,fmatrix,
outf,cons,opencoeff,
extendcoeff,path,compass,&m,&n,len); */
/* JISON new call and reset align */
prophet_scan_profile(substr,name,pname,mlen,fmatrix,
align,cons,opencoeff,
extendcoeff,path,compass,&m,&n,(ajint)len);
ajAlignReset(align);
ajStrDel(&strand);
}
for(i=0;i<mlen;++i)
AJFREE (fmatrix[i]);
AJFREE (fmatrix);
AJFREE(path);
AJFREE(compass);
ajStrDel(&line);
ajStrDel(&cons);
ajStrDel(&name);
ajStrDel(&pname);
ajStrDel(&mname);
ajStrDel(&tname);
ajStrDel(&substr);
ajStrDel(&m);
ajStrDel(&n);
ajSeqDel(&seq);
ajFileClose(&inf);
ajAlignClose(align);
ajAlignDel(&align);
ajSeqallDel(&seqall);
embExit();
return 0;
}
int main(int argc, char **argv) {
embInitPV("kclustalw", argc, argv, "KBWS", "1.0.8");
struct soap soap;
struct ns1__clustalwInputParams params;
char* jobid;
char* result;
AjPSeqall seqall;
AjPSeq seq;
AjPFile outf;
AjPFile outf_dnd;
AjPStr substr;
AjPStr inseq = NULL;
AjPStr alignment;
AjPStr output;
AjPStr matrix;
AjPStr outorder;
ajint ktup;
ajint window;
ajint gapopen;
float gapext;
ajint gapdist;
AjBool endgaps;
ajint pairgap;
ajint topdiags;
AjPStr score;
AjBool tossgaps;
AjBool kimura;
AjPStr outputtree;
AjBool tree;
AjBool quicktree;
AjBool align;
AjPStr clustering;
ajint numiter;
AjPStr iteration;
alignment = ajAcdGetString("alignment");
output = ajAcdGetString("output");
matrix = ajAcdGetString("matrix");
outorder = ajAcdGetString("outorder");
ktup = ajAcdGetInt("ktup");
window = ajAcdGetInt("window");
gapopen = ajAcdGetInt("gapopen");
gapext = ajAcdGetFloat("gapext");
gapdist = ajAcdGetInt("gapdist");
endgaps = ajAcdGetBoolean("endgaps");
pairgap = ajAcdGetInt("pairgap");
topdiags = ajAcdGetInt("topdiags");
score = ajAcdGetString("score");
tossgaps = ajAcdGetBoolean("tossgaps");
kimura = ajAcdGetBoolean("kimura");
outputtree = ajAcdGetString("outputtree");
tree = ajAcdGetBoolean("tree");
quicktree = ajAcdGetBoolean("quicktree");
align = ajAcdGetBoolean("align");
clustering = ajAcdGetString("clustering");
numiter = ajAcdGetInt("numiter");
iteration = ajAcdGetString("iteration");
seqall = ajAcdGetSeqall("seqall");
outf = ajAcdGetOutfile("outfile");
outf_dnd = ajAcdGetOutfile("dndoutfile");
params.alignment = ajCharNewS(alignment);
params.output = ajCharNewS(output);
params.matrix = ajCharNewS(matrix);
params.outorder = ajCharNewS(outorder);
params.ktup = ktup;
params.window = window;
params.gapopen = gapopen;
params.gapext = gapext;
params.gapdist = gapdist;
if (endgaps) {
params.endgaps = xsd__boolean__true_;
} else {
params.endgaps = xsd__boolean__false_;
}
params.pairgap = pairgap;
params.topdiags = topdiags;
params.score = ajCharNewS(score);
if (tossgaps) {
params.tossgaps = xsd__boolean__true_;
} else {
params.tossgaps = xsd__boolean__false_;
}
if (kimura) {
params.kimura = xsd__boolean__true_;
} else {
params.kimura = xsd__boolean__false_;
}
params.outputtree = ajCharNewS(outputtree);
if (tree) {
params.tree = xsd__boolean__true_;
} else {
params.tree = xsd__boolean__false_;
}
if (quicktree) {
params.quicktree = xsd__boolean__true_;
} else {
params.quicktree = xsd__boolean__false_;
}
if (align) {
params.align = xsd__boolean__true_;
} else {
params.align = xsd__boolean__false_;
}
params.clustering = ajCharNewS(clustering);
params.numiter = numiter;
params.iteration = ajCharNewS(iteration);
AjPStr tmp = NULL;
AjPStr tmpFileName = NULL;
AjPSeqout fil_file;
AjPStr line = NULL; /* if "AjPStr line; -> ajReadline is not success!" */
AjPStr sizestr = NULL;
ajint thissize;
ajint nb = 0;
AjBool are_prot = ajFalse;
ajint size = 0;
AjPFile infile;
tmp = ajStrNewC("fasta");
fil_file = ajSeqoutNew();
tmpFileName = getUniqueFileName();
if( !ajSeqoutOpenFilename(fil_file, tmpFileName) ) {
embExitBad();
}
ajSeqoutSetFormatS(fil_file, tmp);
while (ajSeqallNext(seqall, &seq)) {
if (!nb) {
are_prot = ajSeqIsProt(seq);
}
ajSeqoutWriteSeq(fil_file, seq);
++nb;
}
ajSeqoutClose(fil_file);
ajSeqoutDel(&fil_file);
if (nb < 2) {
ajFatal("Multiple alignments need at least two sequences");
}
infile = ajFileNewInNameS(tmpFileName);
while (ajReadline(infile, &line)) {
ajStrAppendS(&inseq,line);
ajStrAppendC(&inseq,"\n");
}
soap_init(&soap);
char* in0;
in0 = ajCharNewS(inseq);
if ( soap_call_ns1__runClustalw( &soap, NULL, NULL, in0, ¶ms, &jobid ) == SOAP_OK ) {
fprintf(stderr,"Jobid: %s\n",jobid);
} else {
soap_print_fault(&soap, stderr);
}
int check = 0;
while ( check == 0 ) {
if ( soap_call_ns1__checkStatus( &soap, NULL, NULL, jobid, &check ) == SOAP_OK ) {
fprintf(stderr,"*");
} else {
soap_print_fault(&soap, stderr);
}
sleep(3);
}
fprintf(stderr,"\n");
char* type;
type = "out";
if(soap_call_ns1__getMultiResult( &soap, NULL, NULL, jobid, type, &result )== SOAP_OK) {
substr = ajStrNewC(result);
fprintf(stdout, "%s\n", ajStrGetPtr(substr));
} else {
soap_print_fault(&soap, stderr);
}
type = "aln";
if(soap_call_ns1__getMultiResult( &soap, NULL, NULL, jobid, type, &result )== SOAP_OK) {
substr = ajStrNewC(result);
ajFmtPrintF(outf,"%S\n",substr);
} else {
soap_print_fault(&soap, stderr);
}
type = "dnd";
if(soap_call_ns1__getMultiResult( &soap, NULL, NULL, jobid, type, &result )== SOAP_OK) {
substr = ajStrNewC(result);
ajFmtPrintF(outf_dnd,"%S\n",substr);
} else {
soap_print_fault(&soap, stderr);
}
ajSysFileUnlinkS(tmpFileName);
soap_destroy(&soap);
soap_end(&soap);
soap_done(&soap);
ajFileClose(&outf_dnd);
ajFileClose(&outf);
ajSeqallDel(&seqall);
ajSeqDel(&seq);
ajStrDel(&substr);
embExit();
return 0;
}
int main(int argc, char *argv[])
{
embInitPV("gaminoinfo", argc, argv, "GEMBASSY", "1.0.1");
struct soap soap;
AjPSeqall seqall;
AjPSeq seq;
AjPStr inseq = NULL;
AjPStr seqid = NULL;
char *in0;
char *result;
AjPFile outf = NULL;
seqall = ajAcdGetSeqall("sequence");
outf = ajAcdGetOutfile("outfile");
while(ajSeqallNext(seqall, &seq))
{
soap_init(&soap);
inseq = NULL;
ajStrAssignS(&seqid, ajSeqGetAccS(seq));
if(!ajStrGetLen(seqid))
ajStrAssignS(&seqid, ajSeqGetNameS(seq));
ajStrAppendC(&inseq, ">");
ajStrAppendS(&inseq, ajSeqGetNameS(seq));
ajStrAppendC(&inseq, "\n");
ajStrAppendS(&inseq, ajSeqGetSeqS(seq));
in0 = ajCharNewS(inseq);
if(soap_call_ns1__amino_USCOREinfo(
&soap,
NULL,
NULL,
in0,
&result
) == SOAP_OK)
{
ajFmtPrintF(outf, "Sequence: %S\n%s\n", seqid, result);
}
else
{
soap_print_fault(&soap, stderr);
}
soap_destroy(&soap);
soap_end(&soap);
soap_done(&soap);
AJFREE(in0);
ajStrDel(&inseq);
}
ajFileClose(&outf);
ajSeqallDel(&seqall);
ajSeqDel(&seq);
embExit();
return 0;
}
int main(int argc, char *argv[])
{
embInitPV("gviewcds", argc, argv, "GEMBASSY", "1.0.1");
AjPSeqall seqall;
AjPSeq seq;
AjPStr inseq = NULL;
ajint length = 0;
ajint gap = 0;
AjBool accid = ajFalse;
AjPStr restid = NULL;
AjPStr seqid = NULL;
AjPStr base = NULL;
AjPStr url = NULL;
AjPFile tmpfile = NULL;
AjPStr tmpname = NULL;
AjBool plot = 0;
AjPFile outf = NULL;
AjPFilebuff buff = NULL;
AjPGraph mult = NULL;
gPlotParams gpp;
AjPStr title = NULL;
AjPPStr names = NULL;
ajint i;
seqall = ajAcdGetSeqall("sequence");
length = ajAcdGetInt("length");
gap = ajAcdGetInt("gap");
accid = ajAcdGetBoolean("accid");
plot = ajAcdGetToggle("plot");
outf = ajAcdGetOutfile("outfile");
mult = ajAcdGetGraphxy("graph");
base = ajStrNewC("rest.g-language.org");
gAssignUniqueName(&tmpname);
while(ajSeqallNext(seqall, &seq))
{
inseq = NULL;
if(!accid)
{
if(gFormatGenbank(seq, &inseq))
{
gAssignUniqueName(&tmpname);
tmpfile = ajFileNewOutNameS(tmpname);
if(!tmpfile)
{
ajFmtError("Output file (%S) open error\n", tmpname);
embExitBad();
}
ajFmtPrintF(tmpfile, "%S", inseq);
ajFileClose(&tmpfile);
ajFmtPrintS(&url, "http://%S/upload/upl.pl", base);
gFilePostSS(url, tmpname, &restid);
ajStrDel(&url);
ajSysFileUnlinkS(tmpname);
}
else
{
ajFmtError("Sequence does not have features\n"
"Proceeding with sequence accession ID\n");
accid = ajTrue;
}
}
if(accid)
{
ajStrAssignS(&seqid, ajSeqGetAccS(seq));
if(!ajStrGetLen(seqid))
{
ajStrAssignS(&seqid, ajSeqGetNameS(seq));
}
if(!ajStrGetLen(seqid))
{
ajFmtError("No valid header information\n");
embExitBad();
}
ajStrAssignS(&restid, seqid);
}
ajStrAssignS(&seqid, ajSeqGetAccS(seq));
url = ajStrNew();
ajFmtPrintS(&url, "http://%S/%S/view_cds/length=%d/gap=%d/"
"output=f/tag=gene", base, restid, length, gap);
if(plot)
{
if((names = (AjPPStr)malloc(sizeof(AjPStr) * 5)) == NULL) {
ajDie("Error in memory allocation, exiting\n");
}
names[0] = NULL;
names[1] = ajStrNewC("A");
names[2] = ajStrNewC("T");
names[3] = ajStrNewC("G");
names[4] = ajStrNewC("C");
title = ajStrNew();
ajStrAppendC(&title, argv[0]);
ajStrAppendC(&title, " of ");
ajStrAppendS(&title, seqid);
gpp.title = ajStrNewS(title);
gpp.xlab = ajStrNewC("position");
gpp.ylab = ajStrNewC("percentage");
gpp.names = names;
if(!gFilebuffURLS(url, &buff))
{
ajDie("File downloading error from:\n%S\n", url);
}
if(!gPlotFilebuff(buff, mult, &gpp))
{
ajDie("Error in plotting\n");
}
i = 0;
while(names[i])
{
AJFREE(names[i]);
++i;
}
AJFREE(names);
AJFREE(gpp.title);
AJFREE(gpp.xlab);
AJFREE(gpp.ylab);
ajStrDel(&title);
ajFilebuffDel(&buff);
}
else
{
ajFmtPrintF(outf, "Sequence: %S\n", seqid);
if(!gFileOutURLS(url, &outf))
{
ajDie("File downloading error from:\n%S\n", url);
}
}
}
ajFileClose(&outf);
ajSeqallDel(&seqall);
ajSeqDel(&seq);
ajStrDel(&seqid);
embExit();
return 0;
}
int main(int argc, char **argv)
{
AjPSeqall seqall;
AjPSeq seq = NULL;
AjPFile outf = NULL;
AjPStr strand = NULL;
AjPStr substr = NULL;
AjPFeattabOut featout;
AjPFeattable feattable=NULL;
ajint begin;
ajint end;
ajint len;
ajint score;
embInit("cpgreport",argc,argv);
seqall = ajAcdGetSeqall("sequence");
score = ajAcdGetInt("score");
outf = ajAcdGetOutfile("outfile");
featout = ajAcdGetFeatout("outfeat");
substr = ajStrNew();
while(ajSeqallNext(seqall, &seq))
{
if (!feattable)
feattable = ajFeattableNewDna(ajSeqGetNameS(seq));
begin = ajSeqallGetseqBegin(seqall);
end = ajSeqallGetseqEnd(seqall);
strand = ajSeqGetSeqCopyS(seq);
ajStrFmtUpper(&strand);
ajStrAssignSubC(&substr,ajStrGetPtr(strand),begin-1,end-1);
len=ajStrGetLen(substr);
ajFmtPrintF(outf,"\n\nCPGREPORT of %s from %d to %d\n\n",
ajSeqGetNameC(seq),begin,begin+len-1);
ajFmtPrintF(outf,"Sequence Begin End Score");
ajFmtPrintF(outf," CpG %%CG CG/GC\n");
cpgreport_cpgsearch(outf,0,len,ajStrGetPtr(substr),ajSeqGetNameC(seq),
begin,score,feattable);
ajStrDel(&strand);
}
ajSeqDel(&seq);
ajStrDel(&substr);
ajFileClose(&outf);
ajFeatSortByStart(feattable);
ajFeattableWrite(featout, feattable);
ajFeattableDel(&feattable);
ajFeattabOutDel(&featout);
ajSeqallDel(&seqall);
ajStrDel(&cpgreportSource);
ajStrDel(&cpgreportType);
embExit();
return 0;
}
int main(int argc, char **argv)
{
AjPAlign align;
AjPSeqall seqall;
AjPSeq a;
AjPSeq b;
AjPStr alga;
AjPStr algb;
AjPStr ss;
ajuint lena;
ajuint lenb;
const char *p;
const char *q;
ajint start1 = 0;
ajint start2 = 0;
ajint *compass;
float* ix;
float* iy;
float* m;
AjPMatrixf matrix;
AjPSeqCvt cvt = 0;
float **sub;
float gapopen;
float gapextend;
float endgapopen;
float endgapextend;
size_t maxarr = 1000; /* arbitrary. realloc'd if needed */
size_t len;
float score;
AjBool dobrief = ajTrue;
AjBool endweight = ajFalse; /* should end gap penalties be applied */
float id = 0.;
float sim = 0.;
float idx = 0.;
float simx = 0.;
AjPStr tmpstr = NULL;
embInit("needle", argc, argv);
matrix = ajAcdGetMatrixf("datafile");
a = ajAcdGetSeq("asequence");
ajSeqTrim(a);
seqall = ajAcdGetSeqall("bsequence");
gapopen = ajAcdGetFloat("gapopen");
gapextend = ajAcdGetFloat("gapextend");
endgapopen = ajAcdGetFloat("endopen");
endgapextend = ajAcdGetFloat("endextend");
dobrief = ajAcdGetBoolean("brief");
endweight = ajAcdGetBoolean("endweight");
align = ajAcdGetAlign("outfile");
gapopen = ajRoundFloat(gapopen, 8);
gapextend = ajRoundFloat(gapextend, 8);
AJCNEW0(compass, maxarr);
AJCNEW0(m, maxarr);
AJCNEW0(ix, maxarr);
AJCNEW0(iy, maxarr);
alga = ajStrNew();
algb = ajStrNew();
ss = ajStrNew();
sub = ajMatrixfGetMatrix(matrix);
cvt = ajMatrixfGetCvt(matrix);
lena = ajSeqGetLen(a);
while(ajSeqallNext(seqall,&b))
{
ajSeqTrim(b);
lenb = ajSeqGetLen(b);
if(lenb > (LONG_MAX/(size_t)(lena+1)))
ajDie("Sequences too big. Try 'stretcher'");
len = (size_t)lena*(size_t)lenb;
if(len>maxarr)
{
AJCRESIZETRY0(compass,(size_t)maxarr,len);
if(!compass)
ajDie("Sequences too big. Try 'stretcher'");
AJCRESIZETRY0(m,(size_t)maxarr,len);
if(!m)
ajDie("Sequences too big. Try 'stretcher'");
AJCRESIZETRY0(ix,(size_t)maxarr,len);
if(!ix)
ajDie("Sequences too big. Try 'stretcher'");
AJCRESIZETRY0(iy,(size_t)maxarr,len);
if(!iy)
ajDie("Sequences too big. Try 'stretcher'");
maxarr=len;
}
p = ajSeqGetSeqC(a);
q = ajSeqGetSeqC(b);
ajStrAssignC(&alga,"");
ajStrAssignC(&algb,"");
score = embAlignPathCalcWithEndGapPenalties(p, q, lena, lenb,
gapopen, gapextend, endgapopen, endgapextend,
&start1, &start2, sub, cvt,
m, ix, iy, compass, ajFalse, endweight);
embAlignWalkNWMatrixUsingCompass(p, q, &alga, &algb,
lena, lenb, &start1, &start2,
compass);
embAlignReportGlobal(align, a, b, alga, algb,
start1, start2,
gapopen, gapextend,
score, matrix,
ajSeqGetOffset(a), ajSeqGetOffset(b));
if(!dobrief)
{
embAlignCalcSimilarity(alga,algb,sub,cvt,lena,lenb,&id,&sim,&idx,
&simx);
ajFmtPrintS(&tmpstr,"Longest_Identity = %5.2f%%\n",
id);
ajFmtPrintAppS(&tmpstr,"Longest_Similarity = %5.2f%%\n",
sim);
ajFmtPrintAppS(&tmpstr,"Shortest_Identity = %5.2f%%\n",
idx);
ajFmtPrintAppS(&tmpstr,"Shortest_Similarity = %5.2f%%",
simx);
ajAlignSetSubHeaderApp(align, tmpstr);
}
ajAlignWrite(align);
ajAlignReset(align);
}
ajAlignClose(align);
ajAlignDel(&align);
ajSeqallDel(&seqall);
ajSeqDel(&a);
ajSeqDel(&b);
AJFREE(compass);
AJFREE(ix);
AJFREE(iy);
AJFREE(m);
ajStrDel(&alga);
ajStrDel(&algb);
ajStrDel(&ss);
ajStrDel(&tmpstr);
embExit();
return 0;
}
int main(int argc, char **argv)
{
AjPSeqset seqset;
AjPSeqall seqall;
AjPSeq queryseq;
const AjPSeq targetseq;
ajint wordlen;
AjPTable wordsTable = NULL;
AjPList* matchlist = NULL;
AjPFile logfile;
AjPFeattable* seqsetftables = NULL;
AjPFeattable seqallseqftable = NULL;
AjPFeattabOut ftoutforseqsetseq = NULL;
AjPFeattabOut ftoutforseqallseq = NULL;
AjPAlign align = NULL;
AjIList iter = NULL;
ajint targetstart;
ajint querystart;
ajint len;
ajuint i, j;
ajulong nAllMatches = 0;
ajulong sumAllScore = 0;
AjBool dumpAlign = ajTrue;
AjBool dumpFeature = ajTrue;
AjBool checkmode = ajFalse;
EmbPWordRK* wordsw = NULL;
ajuint npatterns = 0;
ajuint seqsetsize;
ajuint nmatches;
ajuint* nmatchesseqset;
ajuint* lastlocation; /* Cursors for Rabin-Karp search. */
/* Shows until what point the query sequence was
* scanned for a pattern sequences in the seqset.
*/
char* paddedheader = NULL;
const char* header;
AjPStr padding;
header = "Pattern %S #pat-sequences #all-matches avg-match-length\n";
padding = ajStrNew();
embInit("wordmatch", argc, argv);
wordlen = ajAcdGetInt("wordsize");
seqset = ajAcdGetSeqset("asequence");
seqall = ajAcdGetSeqall("bsequence");
logfile = ajAcdGetOutfile("logfile");
dumpAlign = ajAcdGetToggle("dumpalign");
dumpFeature = ajAcdGetToggle("dumpfeat");
if(dumpAlign)
{
align = ajAcdGetAlign("outfile");
ajAlignSetExternal(align, ajTrue);
}
seqsetsize = ajSeqsetGetSize(seqset);
ajSeqsetTrim(seqset);
AJCNEW0(matchlist, seqsetsize);
AJCNEW0(seqsetftables, seqsetsize);
AJCNEW0(nmatchesseqset, seqsetsize);
if (dumpFeature)
{
ftoutforseqsetseq = ajAcdGetFeatout("aoutfeat");
ftoutforseqallseq = ajAcdGetFeatout("boutfeat");
}
checkmode = !dumpFeature && !dumpAlign;
embWordLength(wordlen);
ajFmtPrintF(logfile, "Small sequence/file for constructing"
" target patterns: %S\n", ajSeqsetGetUsa(seqset));
ajFmtPrintF(logfile, "Large sequence/file to be scanned"
" for patterns: %S\n", ajSeqallGetUsa(seqall));
ajFmtPrintF(logfile, "Number of sequences in the patterns file: %u\n",
seqsetsize);
ajFmtPrintF(logfile, "Pattern/word length: %u\n", wordlen);
for(i=0;i<seqsetsize;i++)
{
targetseq = ajSeqsetGetseqSeq(seqset, i);
embWordGetTable(&wordsTable, targetseq);
}
AJCNEW0(lastlocation, seqsetsize);
if(ajTableGetLength(wordsTable)>0)
{
npatterns = embWordRabinKarpInit(wordsTable,
&wordsw, wordlen, seqset);
ajFmtPrintF(logfile, "Number of patterns/words found: %u\n", npatterns);
while(ajSeqallNext(seqall,&queryseq))
{
for(i=0;i<seqsetsize;i++)
{
lastlocation[i]=0;
if (!checkmode)
matchlist[i] = ajListstrNew();
}
nmatches = embWordRabinKarpSearch(
ajSeqGetSeqS(queryseq), seqset,
(EmbPWordRK const *)wordsw, wordlen, npatterns,
matchlist, lastlocation, checkmode);
nAllMatches += nmatches;
if (checkmode)
continue;
for(i=0;i<seqsetsize;i++)
{
if(ajListGetLength(matchlist[i])>0)
{
iter = ajListIterNewread(matchlist[i]) ;
while(embWordMatchIter(iter, &targetstart, &querystart, &len,
&targetseq))
{
if(dumpAlign)
{
ajAlignDefineSS(align, targetseq, queryseq);
ajAlignSetScoreI(align, len);
/* ungapped alignment means same length
* for both sequences
*/
ajAlignSetSubRange(align, targetstart, 1, len,
ajSeqIsReversed(targetseq),
ajSeqGetLen(targetseq),
querystart, 1, len,
ajSeqIsReversed(queryseq),
ajSeqGetLen(queryseq));
}
}
if(dumpAlign)
{
ajAlignWrite(align);
ajAlignReset(align);
}
if(ajListGetLength(matchlist[i])>0 && dumpFeature)
{
embWordMatchListConvToFeat(matchlist[i],
&seqsetftables[i],
&seqallseqftable,
targetseq, queryseq);
ajFeattableWrite(ftoutforseqallseq, seqallseqftable);
ajFeattableDel(&seqallseqftable);
}
ajListIterDel(&iter);
}
embWordMatchListDelete(&matchlist[i]);
}
}
/* search completed, now report statistics */
for(i=0;i<npatterns;i++)
{
sumAllScore += wordsw[i]->lenMatches;
for(j=0;j<wordsw[i]->nseqs;j++)
nmatchesseqset[wordsw[i]->seqindxs[j]] +=
wordsw[i]->nSeqMatches[j];
}
ajFmtPrintF(logfile, "Number of sequences in the file scanned "
"for patterns: %u\n", ajSeqallGetCount(seqall));
ajFmtPrintF(logfile, "Number of all matches: %Lu"
" (wordmatch finds exact matches only)\n", nAllMatches);
if(nAllMatches>0)
{
ajFmtPrintF(logfile, "Sum of match lengths: %Lu\n", sumAllScore);
ajFmtPrintF(logfile, "Average match length: %.2f\n",
sumAllScore*1.0/nAllMatches);
ajFmtPrintF(logfile, "\nDistribution of the matches among pattern"
" sequences:\n");
ajFmtPrintF(logfile, "-----------------------------------------"
"-----------\n");
for(i=0;i<ajSeqsetGetSize(seqset);i++)
{
if (nmatchesseqset[i]>0)
ajFmtPrintF(logfile, "%-42s: %8u\n",
ajSeqGetNameC(ajSeqsetGetseqSeq(seqset, i)),
nmatchesseqset[i]);
ajFeattableWrite(ftoutforseqsetseq, seqsetftables[i]);
ajFeattableDel(&seqsetftables[i]);
}
ajFmtPrintF(logfile, "\nPattern statistics:\n");
ajFmtPrintF(logfile, "-------------------\n");
if(wordlen>7)
ajStrAppendCountK(&padding, ' ', wordlen-7);
paddedheader = ajFmtString(header,padding);
ajFmtPrintF(logfile, paddedheader);
for(i=0;i<npatterns;i++)
if (wordsw[i]->nMatches>0)
ajFmtPrintF(logfile, "%-7s: %12u %12u %17.2f\n",
wordsw[i]->word->fword, wordsw[i]->nseqs,
wordsw[i]->nMatches,
wordsw[i]->lenMatches*1.0/wordsw[i]->nMatches);
}
}
for(i=0;i<npatterns;i++)
{
for(j=0;j<wordsw[i]->nseqs;j++)
AJFREE(wordsw[i]->locs[j]);
AJFREE(wordsw[i]->locs);
AJFREE(wordsw[i]->seqindxs);
AJFREE(wordsw[i]->nnseqlocs);
AJFREE(wordsw[i]->nSeqMatches);
AJFREE(wordsw[i]);
}
embWordFreeTable(&wordsTable);
AJFREE(wordsw);
AJFREE(matchlist);
AJFREE(lastlocation);
AJFREE(nmatchesseqset);
AJFREE(seqsetftables);
if(dumpAlign)
{
ajAlignClose(align);
ajAlignDel(&align);
}
if(dumpFeature)
{
ajFeattabOutDel(&ftoutforseqsetseq);
ajFeattabOutDel(&ftoutforseqallseq);
}
ajFileClose(&logfile);
ajSeqallDel(&seqall);
ajSeqsetDel(&seqset);
ajSeqDel(&queryseq);
ajStrDel(&padding);
AJFREE(paddedheader);
embExit();
return 0;
}
int main(int argc, char **argv)
{
AjPSeqall seqall;
AjPSeq seq = NULL;
AjPFile outf = NULL;
ajint begin;
ajint end;
ajuint emin;
ajuint emax;
AjPFile mfile = NULL;
EmbPMatPrints s = NULL;
AjPList l = NULL;
AjPStr strand = NULL;
AjPStr substr = NULL;
AjPStr name = NULL;
AjBool all;
AjBool ordered;
ajint hits;
ajint nmotifs;
embInit("pscan", argc, argv);
seqall = ajAcdGetSeqall("sequence");
outf = ajAcdGetOutfile("outfile");
emin = ajAcdGetInt("emin");
emax = ajAcdGetInt("emax");
substr = ajStrNew();
name = ajStrNew();
all = ordered = ajTrue;
while(ajSeqallNext(seqall, &seq))
{
begin = ajSeqallGetseqBegin(seqall);
end = ajSeqallGetseqEnd(seqall);
ajStrAssignC(&name,ajSeqGetNameC(seq));
strand = ajSeqGetSeqCopyS(seq);
ajStrAssignSubC(&substr,ajStrGetPtr(strand),begin-1,end-1);
nmotifs = 0;
ajDebug("pscan sequence '%S'\n", ajSeqGetNameS(seq));
embMatPrintsInit(&mfile);
ajDebug("pscan prints file '%F'\n", mfile);
l = ajListNew();
while((s = embMatProtReadInt(mfile)))
{
ajDebug("pscan file '%F' read\n", mfile);
if(s->n >= emin && s->n <= emax)
{
hits=embMatProtScanInt(substr,name,s,&l,&all,&ordered,
1);
if(hits)
++nmotifs;
}
embMatProtDelInt(&s);
}
pscan_print_hits(outf, l, nmotifs, begin);
ajListFree(&l);
ajStrDel(&strand);
ajFileClose(&mfile);
}
ajStrDel(&substr);
ajStrDel(&name);
ajSeqallDel(&seqall);
ajSeqDel(&seq);
ajFileClose(&outf);
embExit();
return 0;
}
int main(int argc, char **argv)
{
AjPSeqall seqall;
AjPSeq sequence;
AjPFile outfile;
ajint minLen;
ajint maxLen;
ajint maxGap;
ajint beginPos;
ajint endPos;
ajint maxmismatches;
AjPStr seqstr;
ajint current;
ajint rev;
ajint count;
ajint gap;
ajint begin;
ajint end;
ajint mismatches;
ajint mismatchAtEnd;
ajint istart;
ajint iend;
ajint ic;
ajint ir;
AjBool alln; /* TRUE if all of palindrome is N's */
Palindrome pfirstpal;
Palindrome plastpal = NULL;
Palindrome ppal = NULL;
Palindrome pnext = NULL;
AjBool found = AJFALSE;
embInit("palindrome", argc, argv);
seqall = ajAcdGetSeqall("sequence");
minLen = ajAcdGetInt("minpallen");
maxLen = ajAcdGetInt("maxpallen");
maxGap = ajAcdGetInt("gaplimit");
outfile = ajAcdGetOutfile("outfile");
maxmismatches = ajAcdGetInt("nummismatches");
overlap = ajAcdGetBoolean("overlap");
while(ajSeqallNext(seqall, &sequence))
{
beginPos = ajSeqallGetseqBegin(seqall);
endPos = ajSeqallGetseqEnd(seqall);
/* set to NULL to indicate that we have no first palindrome find yet */
pfirstpal = NULL;
/* write header to file */
ajFmtPrintF(outfile, "Palindromes of: %s \n", ajSeqGetNameC(sequence));
ajFmtPrintF(outfile, "Sequence length is: %d \n", ajSeqGetLen(sequence));
ajFmtPrintF(outfile, "Start at position: %d\nEnd at position: %d\n",
beginPos, endPos);
ajFmtPrintF(outfile,"Minimum length of Palindromes is: %d \n", minLen);
ajFmtPrintF(outfile,"Maximum length of Palindromes is: %d \n", maxLen);
ajFmtPrintF(outfile,"Maximum gap between elements is: %d \n", maxGap);
ajFmtPrintF(outfile,"Number of mismatches allowed in Palindrome: %d\n",
maxmismatches);
ajFmtPrintF(outfile, "\n\n\n");
ajFmtPrintF(outfile, "Palindromes:\n");
/* set vars in readiness to enter loop */
seqstr = ajStrNewC(ajSeqGetSeqC(sequence));
begin = beginPos - 1;
end = endPos - 1;
ajStrFmtLower(&seqstr); /* make comparisons case independent */
/* loop to look for inverted repeats */
for(current = begin; current < end; current++)
{
iend = current + 2*(maxLen) + maxGap;
if(iend > end)
iend = end;
istart = current + minLen;
for(rev = iend; rev > istart; rev--)
{
count = 0;
mismatches = 0;
mismatchAtEnd = 0;
alln = ajTrue;
ic = current;
ir = rev;
if(ajStrGetCharPos(seqstr, ic) ==
ajBaseAlphacharComp(ajStrGetCharPos(seqstr, ir)))
while(mismatches <= maxmismatches && ic < ir)
{
if(ajStrGetCharPos(seqstr, ic++) ==
ajBaseAlphacharComp(ajStrGetCharPos(seqstr, ir--)))
{
mismatchAtEnd = 0;
if(ajStrGetCharPos(seqstr, ic-1) != 'n')
alln = ajFalse;
}
else
{
mismatches++;
mismatchAtEnd++;
}
count++;
}
count -= mismatchAtEnd;
gap = rev - current - count - count + 1;
/* Find out if there's a reverse repeat long enough */
if(count >= minLen && gap <= maxGap && !alln)
{
/* create new struct to hold palindrome data */
ppal = palindrome_New(current,(current+count),rev,
(rev-count));
/*
** if it is the first palindrome find then save it as start
** of palindrome list
*/
if(pfirstpal == NULL)
{
pfirstpal = ppal;
plastpal = ppal;
}
else
{
/* Is it a subset of a palindrome already met */
pnext = pfirstpal;
found = AJFALSE;
while(pnext != NULL)
{
if(overlap && palindrome_AInB(ppal, pnext))
{
found = AJTRUE;
break;
}
if(!overlap && palindrome_AOverB(ppal, pnext))
{
if(palindrome_Longer(ppal, pnext))
{
palindrome_Swap(ppal, pnext);
}
found = AJTRUE;
break;
}
pnext = pnext->next;
}
/* if new palindrome add to end of list */
if(!found)
{
plastpal->next = ppal;
plastpal = ppal;
}
else
AJFREE(ppal);
}
}
}
}
/* Print out palindromes */
ppal = pfirstpal;
while(ppal != NULL)
{
palindrome_Print(outfile, seqstr, ppal, maxLen);
ppal = ppal->next;
}
/* make a gap beween outputs of different sequences */
ajFmtPrintF(outfile, "\n\n\n");
/* free memory used for palindrome list */
ppal = pfirstpal;
while(ppal != NULL)
{
pnext = ppal->next;
AJFREE(ppal);
ppal = pnext;
}
ajStrDel(&seqstr);
}
ajFileClose(&outfile);
ajSeqallDel(&seqall);
ajSeqDel(&sequence);
ajStrDel(&seqstr);
embExit();
return 0;
}
int main(int argc, char *argv[])
{
embInitPV("gdeltaenc", argc, argv, "GEMBASSY", "1.0.3");
AjPSeqall seqall;
AjPSeq seq;
AjPStr inseq = NULL;
AjBool accid = ajFalse;
AjPStr restid = NULL;
AjPStr seqid = NULL;
AjPStr base = NULL;
AjPStr url = NULL;
AjPFile tmpfile = NULL;
AjPStr tmpname = NULL;
AjPFilebuff tmp = NULL;
AjPStr line = NULL;
AjPFile outf = NULL;
seqall = ajAcdGetSeqall("sequence");
accid = ajAcdGetBoolean("accid");
outf = ajAcdGetOutfile("outfile");
base = ajStrNewC("rest.g-language.org");
gAssignUniqueName(&tmpname);
while(ajSeqallNext(seqall, &seq))
{
inseq = NULL;
if(!accid)
{
if(gFormatGenbank(seq, &inseq))
{
tmpfile = ajFileNewOutNameS(tmpname);
if(!tmpfile)
{
ajDie("Output file (%S) open error\n", tmpname);
}
ajFmtPrintF(tmpfile, "%S", inseq);
ajFileClose(&tmpfile);
ajFmtPrintS(&url, "http://%S/upload/upl.pl", base);
gFilePostSS(url, tmpname, &restid);
ajStrDel(&url);
ajSysFileUnlinkS(tmpname);
}
else
{
ajWarn("Sequence does not have features\n"
"Proceeding with sequence accession ID\n");
accid = ajTrue;
}
}
ajStrAssignS(&seqid, ajSeqGetAccS(seq));
if(ajStrGetLen(seqid) == 0)
{
ajStrAssignS(&seqid, ajSeqGetNameS(seq));
}
if(ajStrGetLen(seqid) == 0)
{
ajWarn("No valid header information\n");
}
if(accid)
{
ajStrAssignS(&restid, seqid);
if(ajStrGetLen(seqid) == 0)
{
ajDie("Cannot proceed without header with -accid\n");
}
if(!gValID(seqid))
{
ajDie("Invalid accession ID:%S, exiting\n", seqid);
}
}
url = ajStrNew();
ajFmtPrintS(&url, "http://%S/%S/delta_enc/", base, restid);
if(!gFilebuffURLS(url, &tmp))
{
ajDie("Failed to download result from:\n%S\n", url);
}
ajBuffreadLine(tmp, &line);
ajStrRemoveSetC(&line, "\n");
ajFmtPrintF(outf, "Sequence: %S DELTA-ENC %S\n", seqid, line);
ajStrDel(&url);
ajStrDel(&restid);
ajStrDel(&seqid);
ajStrDel(&inseq);
}
ajFileClose(&outf);
ajSeqallDel(&seqall);
ajSeqDel(&seq);
ajStrDel(&base);
embExit();
return 0;
}
int main(int argc, char **argv)
{
AjPSeqall queryseqs;
AjPSeqset targetseqs;
AjPSeq queryseq;
const AjPSeq targetseq;
AjPStr queryaln = 0;
AjPStr targetaln = 0;
AjPFile errorf;
AjBool show = ajFalse;
const char *queryseqc;
const char *targetseqc;
AjPMatrixf matrix;
AjPSeqCvt cvt = 0;
float **sub;
ajint *compass = NULL;
float *path = NULL;
float gapopen;
float gapextend;
float score;
float minscore;
ajuint j, k;
ajint querystart = 0;
ajint targetstart = 0;
ajint queryend = 0;
ajint targetend = 0;
ajint width = 0;
AjPTable kmers = 0;
ajint wordlen = 6;
ajint oldmax = 0;
ajint newmax = 0;
ajuint ntargetseqs;
ajuint nkmers;
AjPAlign align = NULL;
EmbPWordMatch maxmatch; /* match with maximum score */
/* Cursors for the current sequence being scanned,
** i.e., until which location it was scanned.
** Separate cursor/location entries for each sequence in the seqset.
*/
ajuint* lastlocation;
EmbPWordRK* wordsw = NULL;
AjPList* matchlist = NULL;
embInit("supermatcher", argc, argv);
matrix = ajAcdGetMatrixf("datafile");
queryseqs = ajAcdGetSeqall("asequence");
targetseqs= ajAcdGetSeqset("bsequence");
gapopen = ajAcdGetFloat("gapopen");
gapextend = ajAcdGetFloat("gapextend");
wordlen = ajAcdGetInt("wordlen");
align = ajAcdGetAlign("outfile");
errorf = ajAcdGetOutfile("errorfile");
width = ajAcdGetInt("width"); /* width for banded Smith-Waterman */
minscore = ajAcdGetFloat("minscore");
gapopen = ajRoundFloat(gapopen, 8);
gapextend = ajRoundFloat(gapextend, 8);
sub = ajMatrixfGetMatrix(matrix);
cvt = ajMatrixfGetCvt(matrix);
embWordLength(wordlen);
/* seqset sequence is the reference sequence for SAM format */
ajAlignSetRefSeqIndx(align, 1);
ajSeqsetTrim(targetseqs);
ntargetseqs = ajSeqsetGetSize(targetseqs);
AJCNEW0(matchlist, ntargetseqs);
/* get tables of words */
for(k=0;k<ntargetseqs;k++)
{
targetseq = ajSeqsetGetseqSeq(targetseqs, k);
embWordGetTable(&kmers, targetseq);
ajDebug("Number of distinct kmers found so far: %d\n",
ajTableGetLength(kmers));
}
AJCNEW0(lastlocation, ntargetseqs);
if(ajTableGetLength(kmers)<1)
ajErr("no kmers found");
nkmers = embWordRabinKarpInit(kmers, &wordsw, wordlen, targetseqs);
while(ajSeqallNext(queryseqs,&queryseq))
{
ajSeqTrim(queryseq);
queryaln = ajStrNewRes(1+ajSeqGetLen(queryseq));
ajDebug("Read '%S'\n", ajSeqGetNameS(queryseq));
for(k=0;k<ntargetseqs;k++)
{
lastlocation[k]=0;
matchlist[k] = ajListstrNew();
}
embWordRabinKarpSearch(ajSeqGetSeqS(queryseq), targetseqs,
(const EmbPWordRK*)wordsw, wordlen, nkmers,
matchlist, lastlocation, ajFalse);
for(k=0;k<ajSeqsetGetSize(targetseqs);k++)
{
targetseq = ajSeqsetGetseqSeq(targetseqs, k);
ajDebug("Processing '%S'\n", ajSeqGetNameS(targetseq));
if(ajListGetLength(matchlist[k])==0)
{
ajFmtPrintF(errorf,
"No wordmatch start points for "
"%s vs %s. No alignment\n",
ajSeqGetNameC(queryseq),ajSeqGetNameC(targetseq));
embWordMatchListDelete(&matchlist[k]);
continue;
}
/* only the maximum match is used as seed
* (if there is more than one location with the maximum match
* only the first one is used)
* TODO: we should add a new option to make above limit optional
*/
maxmatch = embWordMatchFirstMax(matchlist[k]);
supermatcher_findendpoints(maxmatch,targetseq, queryseq,
&targetstart, &querystart,
&targetend, &queryend);
targetaln=ajStrNewRes(1+ajSeqGetLen(targetseq));
queryseqc = ajSeqGetSeqC(queryseq);
targetseqc = ajSeqGetSeqC(targetseq);
ajStrAssignC(&queryaln,"");
ajStrAssignC(&targetaln,"");
ajDebug("++ %S v %S start:%d %d end:%d %d\n",
ajSeqGetNameS(targetseq), ajSeqGetNameS(queryseq),
targetstart, querystart, targetend, queryend);
newmax = (targetend-targetstart+2)*width;
if(newmax > oldmax)
{
AJCRESIZE0(path,oldmax,newmax);
AJCRESIZE0(compass,oldmax,newmax);
oldmax=newmax;
ajDebug("++ memory re/allocation for path/compass arrays"
" to size: %d\n", newmax);
}
else
{
AJCSET0(path,newmax);
AJCSET0(compass,newmax);
}
ajDebug("Calling embAlignPathCalcSWFast "
"%d..%d [%d/%d] %d..%d [%d/%d] width:%d\n",
querystart, queryend, (queryend - querystart + 1),
ajSeqGetLen(queryseq),
targetstart, targetend, (targetend - targetstart + 1),
ajSeqGetLen(targetseq),
width);
score = embAlignPathCalcSWFast(&targetseqc[targetstart],
&queryseqc[querystart],
targetend-targetstart+1,
queryend-querystart+1,
0,width,
gapopen,gapextend,
path,sub,cvt,
compass,show);
if(score>minscore)
{
embAlignWalkSWMatrixFast(path,compass,gapopen,gapextend,
targetseq,queryseq,
&targetaln,&queryaln,
targetend-targetstart+1,
queryend-querystart+1,
0,width,
&targetstart,&querystart);
if(!ajAlignFormatShowsSequences(align))
{
ajAlignDefineCC(align, ajStrGetPtr(targetaln),
ajStrGetPtr(queryaln),
ajSeqGetNameC(targetseq),
ajSeqGetNameC(queryseq));
ajAlignSetScoreR(align, score);
}
else
{
ajDebug(" queryaln:%S \ntargetaln:%S\n",
queryaln,targetaln);
embAlignReportLocal(align,
queryseq, targetseq,
queryaln, targetaln,
querystart, targetstart,
gapopen, gapextend,
score, matrix,
1 + ajSeqGetOffset(queryseq),
1 + ajSeqGetOffset(targetseq)
);
}
ajAlignWrite(align);
ajAlignReset(align);
}
ajStrDel(&targetaln);
embWordMatchListDelete(&matchlist[k]);
}
ajStrDel(&queryaln);
}
for(k=0;k<nkmers;k++)
{
AJFREE(wordsw[k]->seqindxs);
AJFREE(wordsw[k]->nSeqMatches);
for(j=0;j<wordsw[k]->nseqs;j++)
AJFREE(wordsw[k]->locs[j]);
AJFREE(wordsw[k]->nnseqlocs);
AJFREE(wordsw[k]->locs);
AJFREE(wordsw[k]);
}
embWordFreeTable(&kmers);
if(!ajAlignFormatShowsSequences(align))
ajMatrixfDel(&matrix);
AJFREE(path);
AJFREE(compass);
AJFREE(kmers);
AJFREE(wordsw);
AJFREE(matchlist);
AJFREE(lastlocation);
ajAlignClose(align);
ajAlignDel(&align);
ajSeqallDel(&queryseqs);
ajSeqDel(&queryseq);
ajSeqsetDel(&targetseqs);
ajFileClose(&errorf);
embExit();
return 0;
}
int main(int argc, char *argv[])
{
embInitPV("gcgr", argc, argv, "GEMBASSY", "1.0.1");
struct soap soap;
struct ns1__cgrInputParams params;
AjPSeqall seqall;
AjPSeq seq;
AjPStr inseq = NULL;
AjPStr seqid = NULL;
ajint width = 0;
AjPFile outf = NULL;
AjPStr filename = NULL;
AjPStr outfname = NULL;
AjPStr format = NULL;
ajint i;
char *in0;
char *result;
seqall = ajAcdGetSeqall("sequence");
width = ajAcdGetInt("width");
filename = ajAcdGetString("goutfile");
format = ajAcdGetString("format");
params.width = width;
i = 0;
while(ajSeqallNext(seqall, &seq))
{
soap_init(&soap);
inseq = NULL;
ajStrAppendC(&inseq, ">");
ajStrAppendS(&inseq, ajSeqGetAccS(seq));
ajStrAppendC(&inseq, "\n");
ajStrAppendS(&inseq, ajSeqGetSeqS(seq));
ajStrAssignS(&seqid, ajSeqGetAccS(seq));
in0 = ajCharNewS(inseq);
if(soap_call_ns1__cgr(
&soap,
NULL,
NULL,
in0,
¶ms,
&result
) == SOAP_OK)
{
++i;
outfname = ajStrNewS(ajFmtStr("%S.%d.%S",
filename,
i,
format));
outf = ajFileNewOutNameS(outfname);
if(!outf)
{
ajDie("File open error\n");
}
if(!ajStrMatchC(format, "png"))
{
if(!gHttpConvertC(result, &outf, ajStrNewC("png"), format))
{
ajDie("File downloading error from:\n%s\n", result);
}
else
{
ajFmtPrint("Created %S\n", outfname);
}
}
else
{
if(!gHttpGetBinC(result, &outf))
{
ajDie("File downloading error from:\n%s\n", result);
}
else
{
ajFmtPrint("Created %S\n", outfname);
}
}
ajStrDel(&outfname);
}
else
{
soap_print_fault(&soap, stderr);
}
soap_destroy(&soap);
soap_end(&soap);
soap_done(&soap);
AJFREE(in0);
ajStrDel(&inseq);
}
ajSeqallDel(&seqall);
ajSeqDel(&seq);
ajStrDel(&filename);
embExit();
}
int main(int argc, char **argv) {
embInitPV("kseqboot", argc, argv, "KBWS", "1.0.8");
struct soap soap;
char* jobid;
char* result;
AjPSeqall seqall;
AjPSeq seq;
AjPFile outf;
AjPStr substr;
AjPStr inseq = NULL;
seqall = ajAcdGetSeqall("seqall");
outf = ajAcdGetOutfile("outfile");
AjPStr tmp = NULL;
AjPStr tmpFileName = NULL;
AjPSeqout fil_file;
AjPStr line = NULL;
AjPStr sizestr = NULL;
ajint thissize = 0;
ajint nb = 0;
AjBool are_prot = ajFalse;
ajint size = 0;
AjPFile infile;
tmp = ajStrNewC("fasta");
fil_file = ajSeqoutNew();
tmpFileName = getUniqueFileName();
if( !ajSeqoutOpenFilename(fil_file, tmpFileName) ) {
embExitBad();
}
ajSeqoutSetFormatS(fil_file, tmp);
while (ajSeqallNext(seqall, &seq)) {
if (!nb) {
are_prot = ajSeqIsProt(seq);
}
ajSeqoutWriteSeq(fil_file, seq);
++nb;
}
ajSeqoutClose(fil_file);
ajSeqoutDel(&fil_file);
if (nb < 2) {
ajFatal("Multiple alignments need at least two sequences");
}
infile = ajFileNewInNameS(tmpFileName);
while (ajReadline(infile, &line)) {
ajStrAppendS(&inseq,line);
ajStrAppendC(&inseq,"\n");
}
soap_init(&soap);
char* in0;
in0 = ajCharNewS(inseq);
if ( soap_call_ns1__runSeqboot( &soap, NULL, NULL, in0, &jobid ) == SOAP_OK ) {
fprintf(stderr,"Jobid: %s\n",jobid);
} else {
soap_print_fault(&soap, stderr);
}
int check = 0;
while ( check == 0 ) {
if ( soap_call_ns1__checkStatus( &soap, NULL, NULL, jobid, &check ) == SOAP_OK ) {
fprintf(stderr,"*");
} else {
soap_print_fault(&soap, stderr);
}
sleep(3);
}
fprintf(stderr,"\n");
if ( soap_call_ns1__getResult( &soap, NULL, NULL, jobid, &result ) == SOAP_OK ) {
substr = ajStrNewC(result);
ajFmtPrintF(outf,"%S\n",substr);
} else {
soap_print_fault(&soap, stderr);
}
ajSysFileUnlinkS(tmpFileName);
soap_destroy(&soap);
soap_end(&soap);
soap_done(&soap);
ajFileClose(&outf);
ajSeqallDel(&seqall);
ajSeqDel(&seq);
ajStrDel(&substr);
embExit();
return 0;
}
int main(int argc, char *argv[])
{
embInitPV("gldabias", argc, argv, "GEMBASSY", "1.0.1");
AjPSeqall seqall;
AjPSeq seq;
AjPStr inseq = NULL;
ajint coefficients = 0;
AjPStr variable = NULL;
AjBool accid = ajFalse;
AjPStr restid = NULL;
AjPStr seqid = NULL;
AjPStr base = NULL;
AjPStr url = NULL;
AjPFile tmpfile = NULL;
AjPStr tmpname = NULL;
AjPFilebuff tmp = NULL;
AjPStr line = NULL;
AjPFile outf = NULL;
seqall = ajAcdGetSeqall("sequence");
coefficients = ajAcdGetInt("coefficients");
variable = ajAcdGetSelectSingle("variable");
accid = ajAcdGetBoolean("accid");
outf = ajAcdGetOutfile("outfile");
base = ajStrNewC("rest.g-language.org");
gAssignUniqueName(&tmpname);
while(ajSeqallNext(seqall, &seq))
{
inseq = NULL;
if(!accid)
{
if(gFormatGenbank(seq, &inseq))
{
tmpfile = ajFileNewOutNameS(tmpname);
if(!tmpfile)
{
ajDie("Output file (%S) open error\n", tmpname);
}
ajFmtPrintF(tmpfile, "%S", inseq);
ajFileClose(&tmpfile);
ajFmtPrintS(&url, "http://%S/upload/upl.pl", base);
gFilePostSS(url, tmpname, &restid);
ajStrDel(&url);
ajSysFileUnlinkS(tmpname);
}
else
{
ajDie("Sequence does not have features\n"
"Proceeding with sequence accession ID\n");
accid = ajTrue;
}
}
if(accid)
{
ajStrAssignS(&restid, ajSeqGetAccS(seq));
if(!ajStrGetLen(restid))
{
ajStrAssignS(&restid, ajSeqGetNameS(seq));
}
if(!ajStrGetLen(restid))
{
ajDie("No valid header information\n");
}
}
ajStrAssignS(&seqid, ajSeqGetAccS(seq));
url = ajStrNew();
ajFmtPrintS(&url, "http://%S/%S/lda_bias/coefficients=%d/variable=%S",
base, restid, coefficients, variable);
if(!gFilebuffURLS(url, &tmp))
{
ajDie("Failed to download result from:\n%S\n", url);
}
ajBuffreadLine(tmp, &line);
ajStrRemoveSetC(&line, "\n");
ajFmtPrintF(outf, "Sequence: %S LDA-BIAS: %S\n", seqid, line);
ajStrDel(&url);
ajStrDel(&inseq);
}
ajFileClose(&outf);
ajSeqallDel(&seqall);
ajSeqDel(&seq);
ajStrDel(&seqid);
embExit();
return 0;
}
int main(int argc, char **argv)
{
AjPSeqall seqall;
AjPSeq a;
AjPStr substr;
AjPStr rname;
ajint be;
ajint en;
ajint len;
AjBool unfavoured;
AjBool overlap;
AjBool allpartials;
AjPStr menu;
AjPStr rag;
ajint n = 0;
ajint r = 0;
AjPFile outf = NULL;
AjPReport report = NULL;
AjPFeattable TabRpt = NULL;
AjPStr tmpStr = NULL;
AjPList l;
AjPList pa;
AjPFile mfptr = NULL;
AjBool nterm = ajFalse;
AjBool cterm = ajFalse;
AjBool dorag = ajFalse;
ajint ncomp;
ajint npart;
EmbPPropMolwt *mwdata = NULL;
AjBool mono;
embInit("digest", argc, argv);
seqall = ajAcdGetSeqall("seqall");
menu = ajAcdGetListSingle("menu");
dorag = ajAcdGetBoolean("ragging");
rag = ajAcdGetListSingle("termini");
unfavoured = ajAcdGetBoolean("unfavoured");
overlap = ajAcdGetBoolean("overlap");
allpartials = ajAcdGetBoolean("allpartials");
report = ajAcdGetReport("outfile");
mfptr = ajAcdGetDatafile("mwdata");
mono = ajAcdGetBoolean("mono");
/* obsolete. Can be uncommented in acd file and here to reuse */
/* outf = ajAcdGetOutfile("originalfile"); */
ajStrToInt(menu, &n);
--n;
ajStrToInt(rag, &r);
if(r==2 || r==4)
nterm = ajTrue;
if(r==3 || r==4)
cterm = ajTrue;
mwdata = embPropEmolwtRead(mfptr);
while(ajSeqallNext(seqall, &a))
{
substr = ajStrNew();
be = ajSeqGetBegin(a);
en = ajSeqGetEnd(a);
ajStrAssignSubC(&substr,ajSeqGetSeqC(a),be-1,en-1);
ajStrFmtUpper(&substr);
len = en-be+1;
l = ajListNew();
pa = ajListNew();
rname = ajStrNew();
TabRpt = ajFeattableNewSeq(a);
embPropCalcFragments(ajStrGetPtr(substr),n,&l,&pa,
unfavoured,overlap,
allpartials,&ncomp,&npart,&rname,
nterm, cterm, dorag, mwdata, mono);
if(outf)
ajFmtPrintF(outf,"DIGEST of %s from %d to %d Molwt=%10.3f\n\n",
ajSeqGetNameC(a),be,en,
embPropCalcMolwt(ajSeqGetSeqC(a),0,len-1,mwdata,mono));
if(!ncomp)
{
if(outf)
ajFmtPrintF(outf,
"Is not proteolytically digested using %s\n",
ajStrGetPtr(rname));
}
else
{
if(outf)
{
ajFmtPrintF(outf,"Complete digestion with %s "
"yields %d fragments:\n",
ajStrGetPtr(rname),ncomp);
digest_print_hits(l,outf,be,ajStrGetPtr(substr));
}
ajFmtPrintS(&tmpStr,
"Complete digestion with %S yields %d fragments",
rname,ncomp);
ajReportSetHeaderS(report, tmpStr);
digest_report_hits(TabRpt,l,be, ajStrGetPtr(substr));
ajReportWrite(report, TabRpt, a);
ajFeattableClear(TabRpt);
}
if(overlap && !allpartials && npart)
{
if(outf)
{
ajFmtPrintF(outf,
"\n\nPartial digest with %s yields %d extras.\n",
ajStrGetPtr(rname),npart);
ajFmtPrintF(outf,"Only overlapping partials shown:\n");
digest_print_hits(pa,outf,be,ajStrGetPtr(substr));
}
ajFmtPrintS(&tmpStr,
"\n\nPartial digest with %S yields %d extras.\n",
rname,npart);
ajFmtPrintAppS(&tmpStr,"Only overlapping partials shown:\n");
ajReportSetHeaderS(report, tmpStr);
digest_report_hits(TabRpt, pa,be,ajStrGetPtr(substr));
ajReportWrite(report, TabRpt, a);
ajFeattableClear(TabRpt);
}
if(allpartials && npart)
{
if(outf)
{
ajFmtPrintF(outf,
"\n\nPartial digest with %s yields %d extras.\n",
ajStrGetPtr(rname),npart);
ajFmtPrintF(outf,"All partials shown:\n");
digest_print_hits(pa,outf,be,ajStrGetPtr(substr));
}
ajFmtPrintS(&tmpStr,
"\n\nPartial digest with %S yields %d extras.\n",
rname,npart);
ajFmtPrintAppS(&tmpStr,"All partials shown:\n");
ajReportSetHeaderS(report, tmpStr);
digest_report_hits(TabRpt, pa,be, ajStrGetPtr(substr));
ajReportWrite(report, TabRpt, a);
ajFeattableClear(TabRpt);
}
}
embPropMolwtDel(&mwdata);
ajReportDel(&report);
ajFeattableDel(&TabRpt);
ajSeqDel(&a);
ajSeqallDel(&seqall);
ajStrDel(&rname);
ajStrDel(&substr);
ajListFree(&pa);
ajListFree(&l);
ajStrDel(&menu);
ajStrDel(&rag);
if(outf)
ajFileClose(&outf);
ajFileClose(&mfptr);
ajStrDel(&tmpStr);
embExit();
return 0;
}