Running sequence alignment using biopython - bioinformatics

I am interested in running mafft from biopython. It works fine (code below).
from Bio.Align.Applications import MafftCommandline
mafft_cline=MafftCommandline(input="file.fasta")
print(mafft_cline)
stdout, stderr = mafft_cline()
output.write(stdout)
But I wanted to add in the additional parameter of adjusting the direction of the sequences based on the first sequence (the reference one). In the documentation, I found this written down, but I am not sure how to incorporate it into my code above:
Mafft V6 beta function
_Switch(["--adjustdirection", "adjustdirection"],
"Adjust direction according to the first sequence. "
"Default off."),
# Adjust direction according to the first sequence
# for highly diverged data; very slow
# Mafft V6 beta function
_Switch(["--adjustdirectionaccurately", "adjustdirectionaccurately"],
"Adjust direction according to the first sequence,"
"for highly diverged data; very slow"
"Default off."),
I tried a few things like
mafft_cline=MafftCommandline(input="file.fasta", --adjustdirection)
but it comes back with an error.
Thanks!

You do this by setting the adjustdirection property of mafft_cline. By default, it is False.
>> from Bio.Align.Applications import MafftCommandline
>> mafft_cline = MafftCommandline(input="file.fasta")
>> print(mafft_cline.adjustdirection)
False
>> mafft_cline.adjustdirection = True
We now see that the --adjustdirection switch is added to the commandline.
>> print(mafft_cline)
mafft --adjustdirection file.fasta

Related

Adjusting the MAFFT command line algorithm to better account for gaps

I've been attempting to use the MAFFT command line tool as a means to identify coding regions within a genome. My general process is to align the amino acid consensus sequence of a gene to a translated reading frame of a target sequence. My method has been largely successful. However, I've noticed some peculiar alignments which will unfortunately impede my annotation method. The following is one such example (Note - I've also included a pairwise alignment from the Pairwise2 Biopython module to demonstrate my desired output. Unfortunately, the computation time for Pairwise2 is nearly 20 times slower than MAFFT command line):
from time import *
from Bio.SubsMat import MatrixInfo as matlist
from Bio import pairwise2
from Bio.pairwise2 import format_alignment
from Bio.Align.Applications import MafftCommandline
startTime = time()
sample_tList = [['>Frame 1', 'RIGVGSIPRHLYCQELPLAQPKTCCAETPFRDSPLQGRLGVCPHLASGVALLYGLSTPLTMSGILDRCTCTPNARVFMAEGQVYCTRCLSARSLLPLNLQVPELGVLGLFYRPEEPLRWTLPRAFPTVECSPAGACWLSAIFPIARMTSGNLNFQQRMVRVAAEIYRAGQLTPAVLKVLQVYERGCRWYPIVGPVPGVGVYANSLHVSDKPFPGATHVLTNLPLPQRPKPEDFCPFECAMADVYDIGHGAVMFVAGGKVSWAPRGGDEVRFETVPEELKLIANRLHISFPPHHLVDMSKFAFIVPGSGVSLRVEHQHGCLPADIVPKGNCWWCLFDLLPPGVQNREIRYANQFGYQTKHGVSGKYLQRRLQINGLRAVTDTHGPIVVQYFSVKESWIRHFRLAGEPSLPGFEDLLRIRVESNTSPLADKDEKIFRFGSHKWYGAGKRARKARSGATTTVAHRASSARETRQAKKHEGVDANNAAHLEHYSPPAEGNCGWHCISAIVNRMVNSNFETTLPERVRPSDDWATDEDFVNTIQILRLPAALDRNGACKSAKYVLKLEGEHWTVSVAPGMSPSLLPLECVQGCCEHKGGLGSPDAVEVSGFDPTCLDRLAEVMHLPSSVIPAALAEMSNNSDRPASLVNTAWTVSQFYARHTGGNHRDQVRLGKIISLCQVIEECCCHQNKTNRATPEEVAAKIDQYLRGATSLEECLIKLERVSPPSAADTSFDWNVVLPGVEAAGPTTEQPHANQCCAPVPVVTQEPLDKDSVPLTAFSLSNCYYPAQGDEVRHRERLNSVLSKLEEVVLEEYGLMPTGLGPRPVLPSGLDELKDQMEEDLLKLANAQATSEMMALAAEQVDLKAWVKSYPRWIPPPPPPKVQPRRMKPVKSLPENKPVPAPRRKVRSDPGKSILAVGGPLNFSTPSELVTPLGEPVLMPASQHVSRPVTPLSEPAPVPAPRRIVSRPMTPLSEPTFVFAPWRKSQQVEEANPAAATLTCQDEPLDLSASSQTEYEAYPLAPLENIGVLEAGGQEAEEVLSGISDILDNTNPAPVSSSSSLSSVKITRPKYSAQAIIDSGGPCSGHLQKEKEACLRIMREACDAARLGDPATQEWLSHMWDRVDVLTWRNTSVYQAFRTLDGRFGFLPKMILETPPPYPCGFVMLPHTPTPSVSAESDLTIGSVATEDVPRILGKTENTGNVLNQKPLALFEEEPVCDQPAKDSRTLSRESGDSTTAPPVGTGGAGLPTDLPPLDGVDADGGGLLRTAKGKAERFFDQLSRQVFNIVSHLPVFFSHLFKSDSGYSPGDWGFAAFTLFCLFLCYSYPFFGFAPLLGVFSGSSRRVRMGVFGCWLAFAVGLFKPVSDPVGAACEFDSPECRNILHSFELLKPWDPVRSLVVGPVGLGLAILGRLLGGARYIWHFLLRLGIVADCILAGAYVLSQGRCKKCWGSCIRTAPNEIAFNVFPFTRATRSSLIDLCDRFCAPKGMDPIFLATGWRGCWTGQSPIEQPSEKPIAFAQLDEKRITARTVVSQPYDPNQAVKCLRVLQAGGAMVAEAVPKVVKVSAIPFRAPFFPTGVKVDPECRIVVDPDTFTTALRSGYSTTNLVLGVGDFAQLNGLKIRQISKPSGGGPHLIAALHVACSMVLHMLAGVYVTAVGSCGTGTSDPWCANPFAVPGYGPGSLCTSRLCISQHGLTLPLTALVAGFGLQEIALVVLIFVSIGGMAHRLSCKADMLCILLAIASYVWVPLTWLLCVFPCWLRWFSLHPLTILWLVFFLISVNMPSGILAVVLLVSLWLLGRYTNIAGLVTPYDIHHYTSGPRGVAALATAPDGTYLAAVRRAALTGRTMLFTPSQLGSLLEGAFRTRKPSLNTVNVVGSSMGSGGVFTIDGRIKCVTAAHVLTGNSARVSGVGFNQMLDFDVKGDFAIADCPNWQGVAPKTQFCGDGWTGRAYWLTSSGVEPGVIGDGFAFCFTACGDSGSPVITEAGELVGVHTGSNKQGGGIVTRPSGQFCNVTPIKLSELSEFFAGPKVPLGDVKVGSHIIKDTSEVPSDLCALLAAKPELEGGLSTVQLLCVFFLLWRMMGHAWTPLVAVGFFILNEVLPAVLVRSVFSFGMFALSWLTPWSAQVLMIRLLTAALNRNRVSLIFYSLGAVTGFVADLATTQGHPLQAVMNLSTYAFLPRMMVVTSPVPAIACGVVHLLAIILYLFKYRCLHHVLVGDGAFSAAFFLRYFAEGKLREGVSQSCGMSHESLTGALAIKLSDEDLDFLTKWTDFKCFVSASNMRNAAGQFIEAAYAKALRIELAQLVQVDKVRGTLAKLEAFADTVAPQLSPGDIVVALGHTPVGSIFDLKVGSTKHTLQAIETRVLAGSKMTVARVVDPTPAPPPAPVPIPLPPKVLENGPNAWGGEDRLNKRKRRRMEAVGIFVMDGKKYQKFWDKNSGDVFYEEVHNSTDEWECLRAGDPADFDPETGIQCGHVTIEDKVYNVFTSPSGRRFLVPANPENRRIQWEAARLSVEQALGMMNVDGELTAKELEKLKRIIDKLQGLTKEQCLNCPPVAPAVVAAAWLLLRQRKNFTTGPSPDLTKWPVRLSRTRSSTTNIRLPNRLMVVLCSCAPLFLRLMSSPALMHLLSYLPATGRETLGLMARFGILRPRPPKRKSHLVRKYRLVTLGAVTHLKLVSLISCTLLGATLSGKEFYRIQGLETYLTEPPVTLEAQCMRLPASRPMLLRLMGVPSWPQPCPPVLSCMYRPFQRPSLIILILGLTALNSQSTVVRMLLGTSPNTICPPKALFCLEFFALCGSTCLPMWVSARPFIGLPLTLPRILWLEMGTDFQPRIFRASLKSTFCAHRLCEKTGKLLLLVPSRSSIVGRRRLGQYLALITLRWPTGQRVVLPRASKRHSTRPSPSEKTNLRNYILQFAGALKLILHPAIDPHLQLSAGSLPIFFMNSPVLKSIYRRTCLTAVTTYWLRSPARLREAACRLATRLPPCQTPFTAYMHSTWCSVTLKVVTLMAFCFCKTSSLRTCSRFNPSSIQTTSCCMPSLPPCQITTGGLNITLCVSKRTQRRQPQTRHHFVAGMGVSSLTVTGFLRPSPTIRQAMSLNTTPRRLQYLWTAVLVSMILSGLKSSWLVRSAPARTVTASQARRSSCPCGKNSGPIMKGRSPECAGTAEPRLRTPLPVASTSVLTTPISTSIVLSSGVATRRVLALVVSVNLPWEKAQVLWMRCNKSRISLRGLSCMWSRVSPLLTQVDTKLAADSPLGVASGETKLTCQTVIMPVPPCSPLVKRSTWSLSPPTCCAAGSSSVPPALGKHTGSSNRSRMVMSFTRQLTRPCLTLGLWGCAGSTSQRVRRCNSLPPLVPARGFASWPAVGVLVRIPFWTKQRIAITLMSGFLAKPPLPAEISNNSTRWVLTLIAMFLTSCLRPNRPSGDSDRISVMPSNQITGTNLCPWSTQPVPRWTNLSGMGKSSPPTTGTERTAPSLSTPVKVPHLMWLHCICPLKIHSTGNEPLLLSPGQDMQSSCMTHTGNCRACLIFLRKAHPSTSQCSVTSSSYIEITKNARLLRLAMEINSGLQTSALILSAPFVQIWKGRAPRSPKLHITWGSISHLIHSLLNSQQNSHPTGPWQPRTMKSGLIGWLPAFAPSINIAARALVQAIWWAPRCFAPQGLCHTTSQNLLGARLKCFLRQSSAPAELRIAGSTSMIGSEKLLSPSHMPSLATSKALPVGDVITSPPDTFRASFLRNQLRSGFLAPEKLQRQFAHQMCTSQILKRTSTQRPSPSAGKCWILEKSDWSGKTRRPIFNLKAAISPGINLQATPHTSEFLLILQCIWTPAWALPFATGGLLGPPIGELTSRSPLMITVPKSFCLVHTMVKCLQGTKFWRARSSRLTTQGTNTLGDLNRIQRICTSLLGMVRTGRIIMKRFGRARKGKFIRLLPPASFIFPRALSLNQLATEMKWGLCRASLTKLVNFLWMLSRNFWCPLLISSYFWPFCLASPSPAGWWSFASDWFAPRYSVRALPFTLSNYRRSYEAFLSQCQVDIPTWGVKHPLGILWHHKVSTLIDEMVSRRMYRIMEKAGQAAWKQVVSEATLSRISNLDVVAHFQHLAAIEAETYKYLASRLPMLHNLRMTGSNVTIVYNSTLNQVFAIFPTSGSRPRLHDSQQWLIAVHSSIFSSVVASCTLFVVLWLRIPMLRSVFGFRWLGAIFLLNSRITRCVRLASPGRPLLRSMNPVGLFGAGGMTDAVRTTMTNGSWFRLASAKATPVFTPGWRSCHSATRPSSIPRYLGGTVKFMLTSRTNSFAPSTTGRTPPCLAMTTFQPYFRPTTNIRSTAVIGFTNGCAPSFPLGWFMFRGFSGVRLQAMFQFKSFRHQDQHYRSIRLCCPPGHQLPVWRLAPSDGSQELSVPHGDRDTRVHHHHSQCHRELFTFFSPHAFLLPFLCFDEKGIQSGIWQCVRHRGCVCLYQLRPTCQGVHPTLLGSRSCATASFHDTDHEVGNRFSLSFCHPTGNLNVQVCWGNAPRAVTRNCFLCGVSCRSVLLCSSTPAATAALIFSFITRYVSMAQIGWQKDLTGQWRLLSFFLCLTLFPMEHSPPAIFLTRLVSLCPPPGSITGGMSVVSMRSVLWLRFASSLGLRRTACPGATLVLDTPTSFWTLRADSIVGGRPLLRKGVRLKSRVTSTSKELCLMVPWQPLPEFQRNNGVVSRRLLPHGSTKGAFGVFHYLYASDDICSKGKSRPTARASAPFDLPELCFYLRVHDIRALSEHKGRAHYGGSSCTSLGGVLSHRNLEIHHLQMPFVLARPQVHSGPCPPRRKCRGLSSDCGKPRICRPASRLHYGRHIGARVEKPRVGWQKSCTGSGKPCQICQITTASSKRERRGTASQSISCARCWVRSSPNKTSPEARDRGRKIIREARRSPIFLRLKKMSGTTSPLVSGNCVCRRSRLPLTRAPGHVPCQIQGGVTLWSLVCRRIILCASASQHHPQHDELAFFGHLGVMIGRMCGEWHLTLCLVTYSIRATVWGSLIGENHAAAIKKKKKKKK'], ['>ORF2_GP2', 'MKWGLCKASLTKLANFLWMLSRSFWCPLLISSYFWPFCLASQSPVGWWSFASDWFAPRYSVRALPFTLSNYRRSYEAFLSQCQVDIPTWGVKHPLGVLWHHKVSTLIDEMVSRRMYRIMEKAGQAAWKQVVSEATLSRISGLDVVAHFQHLAAIEAETCKYLASRLPMLHNLRLTGSNVTIVYNSTLDQVFAIFPTPGSRPKLHDFQQWLIAVHSSIFSSVAASCTLFVVLWLRIPMLRSVFGFRWLGATFLLNSW']]
ex_file = open("newTempFile112233.fasta", "w")
for items in sample_tList:
ex_file.write(items[0] + "\n")
ex_file.write(items[1] + "\n")
ex_file.close()
in_file = '.../msa_example.fasta'
mafft_exe = '/usr/local/bin/mafft'
mafft_cline = MafftCommandline(mafft_exe, input=in_file) #have to change file path
#mafft_cline = MafftCommandline(mafft_exe, input=in_file, localpair=True, lexp=-1.5, lop=0.5)
stdout, stderr = mafft_cline()
print(stdout)
test_align = AlignIO.read(io.StringIO(stdout), "fasta")
#print(test_align)
os.remove("newTempFile112233.fasta")
print('Total time = ' + str(time() - startTime))
startTime = time()
matrix = matlist.blosum62
pWise_align = pairwise2.align.localds(sample_tList[0][1], sample_tList[1][1], matrix, -6, -1)
print(format_alignment(*pWise_align[0]))
print('Total time = ' + str(time() - startTime))
I've attempted to change the MAFFT command line alignment algorithm by referencing the help document (http://mafft.cbrc.jp/alignment/software/manual/manual.html). I don't get any error messages, but the alignment output does not change. I'm unsure what adjustments need to be made. I believe that by increasing the gap extension penalty (which is zero by default), the alignment will be improved. I haven't been able to find many documentation examples where custom variables are used when using MAFFT command line on this forum or through Google search. Help is much appreciated. For reference, documentation on the Pairwise2 alignment parameters can be found here: http://biopython.org/DIST/docs/api/Bio.pairwise2-module.html
Managed to figure out a possible solution. The alignment of the example sequences provided results in a long terminal/end gap which should not be present. Changing the MAFFT alignment algorithm using localpair, lexp, and lop had no effect (causing me a good deal of confusion). However, I have noticed differences in the alignment output when each input sequence is reversed. Oddly, the only way I was able to remove the terminal/end gap was to set the lop (gap opening penalty) to a lesser amount relative to lexp (gap extension penalty). I suspect my solution is niche and may not be applicable to other similar occurrences of terminal gaps. Changing the alignment settings also likely reduces the optimal alignment.
Going forward, I plan to use an automated process to run alignments of consensus sequences to raw sequences. In the event I detect irregularities with the alignment output (specifically terminal gaps), I'll attempt to reverse the input sequences and apply custom alignment settings. I suppose if that isn't a consistent solution, I'll figure out a way to refine the alignment output directly.
For anyone curious, I used a lexp value of -1.5 and lop value of 0.5 (now included in a hashed out line in my example code).

difference between iterating lines with while and array assignment

I'm writing a perl script that reads a file into an array. I wrote the program on Windows, using Perl 5.16 (it also works on 5.14), and the script failed using a Mac with Perl 5.12.
The part that failed is this: my #array = <$file>. On the Mac, the array came back the correct size (same as number of lines in the file), but every element except the last one was empty. The code worked correctly when I switched to this instead:
my #array;
while(<$file>){
push #array, $_;
}
I'm not sure if it would have made a difference if I switched the line endings to be LF instead of CRLF (Windows style). Though the problem is fixed, it leaves me puzzled. I thought those two code snippets I listed were exactly the same thing. What is the difference in them that produces different results here?
The answer is that the two methods are exactly equivalent, as you suspected. Example:
my $start = tell DATA; #store beginning filehandle position
my #array1 = <DATA>;
seek DATA,$start,0; #reset filehandle position
my #array2;
while(<DATA>){
push #array2,$_;
}
print "List assignment:\n #array1\n";
print "Looping through:\n #array2\n";
__DATA__
1
2
foo
bar
Your previous failure was likely something else. Perhaps some sort of problem with Perl on Mac or Mac's file IO was involved, but more likely it was some other part of your code (by this I mean nothing personal: I would make the same assumption about my own code).

Reformatting text (or, better, LaTeX) in 80 colums in SciTE

I recently dived into LaTeX, starting with the help of a WYSIWYM editor like Lix. Now I'm staring writing tex files in Sci-TE, It already has syntax higlighting and I adapted the tex.properties file to work in Windows showing a preview on Go [F5]
One pretty thing Lyx does, and it's hard to acheive with a common text editor, is to format text in 80 columns: I can write a paragraph and hit Return each time I reach near the edge column but if, after the first draft, I want to add or cut some words here and there I end up breaking the layout and having to rearrange newlines.
It would be useful to have a tool in Sci-TE so I can select a paragraph of text I added or deleted some words in and have it rearranged in 80 columns. Probably not something working on the whole document since it could probably break some intended anticipated line break.
Probably I could easily write a Python plugin for geany, I saw vim has something similar, but I'd like to know if its' possible in Sci-TE too.
I was a bit disappointed when I found no answer as I was searching for same. No helpers by Google either, so I searched for Lua examples and syntax in a hope to craft it myself. I don't know Lua so this can perhaps be made differently or efficiently but its better then nothing I hope - here is Lua function which needs to be put in SciTE start-up Lua script:
function wrap_text()
local border = 80
local t = {}
local pos = editor.SelectionStart
local sel = editor:GetSelText()
if #sel == 0 then return end
local para = {}
local function helper(line) table.insert(para, line) return "" end
helper((sel:gsub("(.-)\r?\n", helper)))
for k, v in pairs(para) do
line = ""
for token in string.gmatch(v, "[^%s]+") do
if string.len(token .. line) >= border then
t[#t + 1] = line
line = token .. " "
else
line = line .. token .. " "
end
end
t[#t + 1] = line:gsub("%s$", "")
end
editor:ReplaceSel(table.concat(t, "\n"))
editor:GotoPos(pos)
end
Usage is like any other function from start-up script, but for completness I'll paste my tool definition from SciTE properties file:
command.name.8.*=Wrap Text
command.mode.8.*=subsystem:lua,savebefore:no,groupundo
command.8.*=wrap_text
command.replace.selection.8.*=2
It does respect paragraphs, so it can be used on broader selection, not just one paragraph.
This is one way to do it in scite: first, add this to your .SciTEUser.properties (Options/Open User Options file):
# Column guide, indicates long lines (https://wiki.archlinux.org/index.php/SciTE)
# this is what they call "margin line" in gedit (at right),
# in scite, "margin" is the area on left for line numbers
edge.mode=1
edge.column=80
... and save, so you can see a line at 80 characters.
Then scale the scite window, so the text you see is wrapped at the line.
Finally, select the long line text which is to be broken into lines, and do Edit / Paragraph / Split (for me the shortcut Ctrl-K also works for that).
Unfortunately, there seems to be no "break-lines-as-you-type" facility in scite, like the "Line Breaking" facility in geany. not anymore, now there's a plugin - see this answer
Well, I was rather disappointed that there seems to be no "break-lines-as-you-type" facility in scite; and I finally managed to code a small Lua plugin/add-on/extension for that, and released it here:
lua-users wiki: Scite Line Break
Installation and usage instructions are in the script itself. Here is how SciTE may look when the extension properly installed, and toggle activated after startup:
Note that it's pretty much the same functionality as in geany - it inserts linebreaks upon typing text - but not on pressing backspace, nor upon copy/pasting.
the same but more easy, I think...
put this in the user properties:
command.name.0.*=swrap
command.0.*=fold -s $(FileNameExt) > /tmp/scite_temp ; cat /tmp/scite_temp >$(FileNameExt)
command.is.filter.0.*=1
Ciao
Pietro

What is your favorite R debugging trick? [duplicate]

I get an error when using an R function that I wrote:
Warning messages:
1: glm.fit: algorithm did not converge
2: glm.fit: algorithm did not converge
What I have done:
Step through the function
Adding print to find out at what line the error occurs suggests two functions that should not use glm.fit. They are window() and save().
My general approaches include adding print and stop commands, and stepping through a function line by line until I can locate the exception.
However, it is not clear to me using those techniques where this error comes from in the code. I am not even certain which functions within the code depend on glm.fit. How do I go about diagnosing this problem?
I'd say that debugging is an art form, so there's no clear silver bullet. There are good strategies for debugging in any language, and they apply here too (e.g. read this nice article). For instance, the first thing is to reproduce the problem...if you can't do that, then you need to get more information (e.g. with logging). Once you can reproduce it, you need to reduce it down to the source.
Rather than a "trick", I would say that I have a favorite debugging routine:
When an error occurs, the first thing that I usually do is look at the stack trace by calling traceback(): that shows you where the error occurred, which is especially useful if you have several nested functions.
Next I will set options(error=recover); this immediately switches into browser mode where the error occurs, so you can browse the workspace from there.
If I still don't have enough information, I usually use the debug() function and step through the script line by line.
The best new trick in R 2.10 (when working with script files) is to use the findLineNum() and setBreakpoint() functions.
As a final comment: depending upon the error, it is also very helpful to set try() or tryCatch() statements around external function calls (especially when dealing with S4 classes). That will sometimes provide even more information, and it also gives you more control over how errors are handled at run time.
These related questions have a lot of suggestions:
Debugging tools for the R language
Debugging lapply/sapply calls
Getting the state of variables after an error occurs in R
R script line numbers at error?
The best walkthrough I've seen so far is:
http://www.biostat.jhsph.edu/%7Erpeng/docs/R-debug-tools.pdf
Anybody agree/disagree?
As was pointed out to me in another question, Rprof() and summaryRprof() are nice tools to find slow parts of your program that might benefit from speeding up or moving to a C/C++ implementation. This probably applies more if you're doing simulation work or other compute- or data-intensive activities. The profr package can help visualizing the results.
I'm on a bit of a learn-about-debugging kick, so another suggestion from another thread:
Set options(warn=2) to treat warnings like errors
You can also use options to drop you right into the heat of the action when an error or warning occurs, using your favorite debugging function of choice. For instance:
Set options(error=recover) to run recover() when an error occurs, as Shane noted (and as is documented in the R debugging guide. Or any other handy function you would find useful to have run.
And another two methods from one of #Shane's links:
Wrap an inner function call with try() to return more information on it.
For *apply functions, use .inform=TRUE (from the plyr package) as an option to the apply command
#JoshuaUlrich also pointed out a neat way of using the conditional abilities of the classic browser() command to turn on/off debugging:
Put inside the function you might want to debug browser(expr=isTRUE(getOption("myDebug")))
And set the global option by options(myDebug=TRUE)
You could even wrap the browser call: myBrowse <- browser(expr=isTRUE(getOption("myDebug"))) and then call with myBrowse() since it uses globals.
Then there are the new functions available in R 2.10:
findLineNum() takes a source file name and line number and returns the function and environment. This seems to be helpful when you source() a .R file and it returns an error at line #n, but you need to know what function is located at line #n.
setBreakpoint() takes a source file name and line number and sets a breakpoint there
The codetools package, and particularly its checkUsage function can be particularly helpful in quickly picking up syntax and stylistic errors that a compiler would typically report (unused locals, undefined global functions and variables, partial argument matching, and so forth).
setBreakpoint() is a more user-friendly front-end to trace(). Details on the internals of how this works are available in a recent R Journal article.
If you are trying to debug someone else's package, once you have located the problem you can over-write their functions with fixInNamespace and assignInNamespace, but do not use this in production code.
None of this should preclude the tried-and-true standard R debugging tools, some of which are above and others of which are not. In particular, the post-mortem debugging tools are handy when you have a time-consuming bunch of code that you'd rather not re-run.
Finally, for tricky problems which don't seem to throw an error message, you can use options(error=dump.frames) as detailed in this question:
Error without an error being thrown
At some point, glm.fit is being called. That means one of the functions you call or one of the functions called by those functions is using either glm, glm.fit.
Also, as I mention in my comment above, that is a warning not an error, which makes a big difference. You can't trigger any of R's debugging tools from a warning (with default options before someone tells me I am wrong ;-).
If we change the options to turn warnings into errors then we can start to use R's debugging tools. From ?options we have:
‘warn’: sets the handling of warning messages. If ‘warn’ is
negative all warnings are ignored. If ‘warn’ is zero (the
default) warnings are stored until the top-level function
returns. If fewer than 10 warnings were signalled they will
be printed otherwise a message saying how many (max 50) were
signalled. An object called ‘last.warning’ is created and
can be printed through the function ‘warnings’. If ‘warn’ is
one, warnings are printed as they occur. If ‘warn’ is two or
larger all warnings are turned into errors.
So if you run
options(warn = 2)
then run your code, R will throw an error. At which point, you could run
traceback()
to see the call stack. Here is an example.
> options(warn = 2)
> foo <- function(x) bar(x + 2)
> bar <- function(y) warning("don't want to use 'y'!")
> foo(1)
Error in bar(x + 2) : (converted from warning) don't want to use 'y'!
> traceback()
7: doWithOneRestart(return(expr), restart)
6: withOneRestart(expr, restarts[[1L]])
5: withRestarts({
.Internal(.signalCondition(simpleWarning(msg, call), msg,
call))
.Internal(.dfltWarn(msg, call))
}, muffleWarning = function() NULL)
4: .signalSimpleWarning("don't want to use 'y'!", quote(bar(x +
2)))
3: warning("don't want to use 'y'!")
2: bar(x + 2)
1: foo(1)
Here you can ignore the frames marked 4: and higher. We see that foo called bar and that bar generated the warning. That should show you which functions were calling glm.fit.
If you now want to debug this, we can turn to another option to tell R to enter the debugger when it encounters an error, and as we have made warnings errors we will get a debugger when the original warning is triggered. For that you should run:
options(error = recover)
Here is an example:
> options(error = recover)
> foo(1)
Error in bar(x + 2) : (converted from warning) don't want to use 'y'!
Enter a frame number, or 0 to exit
1: foo(1)
2: bar(x + 2)
3: warning("don't want to use 'y'!")
4: .signalSimpleWarning("don't want to use 'y'!", quote(bar(x + 2)))
5: withRestarts({
6: withOneRestart(expr, restarts[[1]])
7: doWithOneRestart(return(expr), restart)
Selection:
You can then step into any of those frames to see what was happening when the warning was thrown.
To reset the above options to their default, enter
options(error = NULL, warn = 0)
As for the specific warning you quote, it is highly likely that you need to allow more iterations in the code. Once you've found out what is calling glm.fit, work out how to pass it the control argument using glm.control - see ?glm.control.
So browser(), traceback() and debug() walk into a bar, but trace() waits outside and keeps the motor running.
By inserting browser somewhere in your function, the execution will halt and wait for your input. You can move forward using n (or Enter), run the entire chunk (iteration) with c, finish the current loop/function with f, or quit with Q; see ?browser.
With debug, you get the same effect as with browser, but this stops the execution of a function at its beginning. Same shortcuts apply. This function will be in a "debug" mode until you turn it off using undebug (that is, after debug(foo), running the function foo will enter "debug" mode every time until you run undebug(foo)).
A more transient alternative is debugonce, which will remove the "debug" mode from the function after the next time it's evaluated.
traceback will give you the flow of execution of functions all the way up to where something went wrong (an actual error).
You can insert code bits (i.e. custom functions) in functions using trace, for example browser. This is useful for functions from packages and you're too lazy to get the nicely folded source code.
My general strategy looks like:
Run traceback() to see look for obvious issues
Set options(warn=2) to treat warnings like errors
Set options(error=recover) to step into the call stack on error
After going through all the steps suggested here I just learned that setting .verbose = TRUE in foreach() also gives me tons of useful information. In particular foreach(.verbose=TRUE) shows exactly where an error occurs inside the foreach loop, while traceback() does not look inside the foreach loop.
Mark Bravington's debugger which is available as the package debug on CRAN is very good and pretty straight forward.
library(debug);
mtrace(myfunction);
myfunction(a,b);
#... debugging, can query objects, step, skip, run, breakpoints etc..
qqq(); # quit the debugger only
mtrace.off(); # turn off debugging
The code pops up in a highlighted Tk window so you can see what's going on and, of course you can call another mtrace() while in a different function.
HTH
I like Gavin's answer: I did not know about options(error = recover). I also like to use the 'debug' package that gives a visual way to step through your code.
require(debug)
mtrace(foo)
foo(1)
At this point it opens up a separate debug window showing your function, with a yellow line showing where you are in the code. In the main window the code enters debug mode, and you can keep hitting enter to step through the code (and there are other commands as well), and examine variable values, etc. The yellow line in the debug window keeps moving to show where you are in the code. When done with debugging, you can turn off tracing with:
mtrace.off()
Based on the answer I received here, you should definitely check out the options(error=recover) setting. When this is set, upon encountering an error, you'll see text on the console similar to the following (traceback output):
> source(<my filename>)
Error in plot.window(...) : need finite 'xlim' values
In addition: Warning messages:
1: In xy.coords(x, y, xlabel, ylabel, log) : NAs introduced by coercion
2: In min(x) : no non-missing arguments to min; returning Inf
3: In max(x) : no non-missing arguments to max; returning -Inf
Enter a frame number, or 0 to exit
1: source(<my filename>)
2: eval.with.vis(ei, envir)
3: eval.with.vis(expr, envir, enclos)
4: LinearParamSearch(data = dataset, y = data.frame(LGD = dataset$LGD10), data.names = data
5: LinearParamSearch.R#66: plot(x = x, y = y.data, xlab = names(y), ylab = data.names[i])
6: LinearParamSearch.R#66: plot.default(x = x, y = y.data, xlab = names(y), ylab = data.nam
7: LinearParamSearch.R#66: localWindow(xlim, ylim, log, asp, ...)
8: LinearParamSearch.R#66: plot.window(...)
Selection:
At which point you can choose which "frame" to enter. When you make a selection, you'll be placed into browser() mode:
Selection: 4
Called from: stop(gettextf("replacement has %d rows, data has %d", N, n),
domain = NA)
Browse[1]>
And you can examine the environment as it was at the time of the error. When you're done, type c to bring you back to the frame selection menu. When you're done, as it tells you, type 0 to exit.
I gave this answer to a more recent question, but am adding it here for completeness.
Personally I tend not to use functions to debug. I often find that this causes as much trouble as it solves. Also, coming from a Matlab background I like being able to do this in an integrated development environment (IDE) rather than doing this in the code. Using an IDE keeps your code clean and simple.
For R, I use an IDE called "RStudio" (http://www.rstudio.com), which is available for windows, mac, and linux and is pretty easy to use.
Versions of Rstudio since about October 2013 (0.98ish?) have the capability to add breakpoints in scripts and functions: to do this, just click on the left margin of the file to add a breakpoint. You can set a breakpoint and then step through from that point on. You also have access to all of the data in that environment, so you can try out commands.
See http://www.rstudio.com/ide/docs/debugging/overview for details. If you already have Rstudio installed, you may need to upgrade - this is a relatively new (late 2013) feature.
You may also find other IDEs that have similar functionality.
Admittedly, if it's a built-in function you may have to resort to some of the suggestions made by other people in this discussion. But, if it's your own code that needs fixing, an IDE-based solution might be just what you need.
To debug Reference Class methods without instance reference
ClassName$trace(methodName, browser)
I am beginning to think that not printing error line number - a most basic requirement - BY DEFAILT- is some kind of a joke in R/Rstudio. The only reliable method I have found to find where an error occurred is to make the additional effort of calloing traceback() and see the top line.

Debugging tools for the R language [duplicate]

I get an error when using an R function that I wrote:
Warning messages:
1: glm.fit: algorithm did not converge
2: glm.fit: algorithm did not converge
What I have done:
Step through the function
Adding print to find out at what line the error occurs suggests two functions that should not use glm.fit. They are window() and save().
My general approaches include adding print and stop commands, and stepping through a function line by line until I can locate the exception.
However, it is not clear to me using those techniques where this error comes from in the code. I am not even certain which functions within the code depend on glm.fit. How do I go about diagnosing this problem?
I'd say that debugging is an art form, so there's no clear silver bullet. There are good strategies for debugging in any language, and they apply here too (e.g. read this nice article). For instance, the first thing is to reproduce the problem...if you can't do that, then you need to get more information (e.g. with logging). Once you can reproduce it, you need to reduce it down to the source.
Rather than a "trick", I would say that I have a favorite debugging routine:
When an error occurs, the first thing that I usually do is look at the stack trace by calling traceback(): that shows you where the error occurred, which is especially useful if you have several nested functions.
Next I will set options(error=recover); this immediately switches into browser mode where the error occurs, so you can browse the workspace from there.
If I still don't have enough information, I usually use the debug() function and step through the script line by line.
The best new trick in R 2.10 (when working with script files) is to use the findLineNum() and setBreakpoint() functions.
As a final comment: depending upon the error, it is also very helpful to set try() or tryCatch() statements around external function calls (especially when dealing with S4 classes). That will sometimes provide even more information, and it also gives you more control over how errors are handled at run time.
These related questions have a lot of suggestions:
Debugging tools for the R language
Debugging lapply/sapply calls
Getting the state of variables after an error occurs in R
R script line numbers at error?
The best walkthrough I've seen so far is:
http://www.biostat.jhsph.edu/%7Erpeng/docs/R-debug-tools.pdf
Anybody agree/disagree?
As was pointed out to me in another question, Rprof() and summaryRprof() are nice tools to find slow parts of your program that might benefit from speeding up or moving to a C/C++ implementation. This probably applies more if you're doing simulation work or other compute- or data-intensive activities. The profr package can help visualizing the results.
I'm on a bit of a learn-about-debugging kick, so another suggestion from another thread:
Set options(warn=2) to treat warnings like errors
You can also use options to drop you right into the heat of the action when an error or warning occurs, using your favorite debugging function of choice. For instance:
Set options(error=recover) to run recover() when an error occurs, as Shane noted (and as is documented in the R debugging guide. Or any other handy function you would find useful to have run.
And another two methods from one of #Shane's links:
Wrap an inner function call with try() to return more information on it.
For *apply functions, use .inform=TRUE (from the plyr package) as an option to the apply command
#JoshuaUlrich also pointed out a neat way of using the conditional abilities of the classic browser() command to turn on/off debugging:
Put inside the function you might want to debug browser(expr=isTRUE(getOption("myDebug")))
And set the global option by options(myDebug=TRUE)
You could even wrap the browser call: myBrowse <- browser(expr=isTRUE(getOption("myDebug"))) and then call with myBrowse() since it uses globals.
Then there are the new functions available in R 2.10:
findLineNum() takes a source file name and line number and returns the function and environment. This seems to be helpful when you source() a .R file and it returns an error at line #n, but you need to know what function is located at line #n.
setBreakpoint() takes a source file name and line number and sets a breakpoint there
The codetools package, and particularly its checkUsage function can be particularly helpful in quickly picking up syntax and stylistic errors that a compiler would typically report (unused locals, undefined global functions and variables, partial argument matching, and so forth).
setBreakpoint() is a more user-friendly front-end to trace(). Details on the internals of how this works are available in a recent R Journal article.
If you are trying to debug someone else's package, once you have located the problem you can over-write their functions with fixInNamespace and assignInNamespace, but do not use this in production code.
None of this should preclude the tried-and-true standard R debugging tools, some of which are above and others of which are not. In particular, the post-mortem debugging tools are handy when you have a time-consuming bunch of code that you'd rather not re-run.
Finally, for tricky problems which don't seem to throw an error message, you can use options(error=dump.frames) as detailed in this question:
Error without an error being thrown
At some point, glm.fit is being called. That means one of the functions you call or one of the functions called by those functions is using either glm, glm.fit.
Also, as I mention in my comment above, that is a warning not an error, which makes a big difference. You can't trigger any of R's debugging tools from a warning (with default options before someone tells me I am wrong ;-).
If we change the options to turn warnings into errors then we can start to use R's debugging tools. From ?options we have:
‘warn’: sets the handling of warning messages. If ‘warn’ is
negative all warnings are ignored. If ‘warn’ is zero (the
default) warnings are stored until the top-level function
returns. If fewer than 10 warnings were signalled they will
be printed otherwise a message saying how many (max 50) were
signalled. An object called ‘last.warning’ is created and
can be printed through the function ‘warnings’. If ‘warn’ is
one, warnings are printed as they occur. If ‘warn’ is two or
larger all warnings are turned into errors.
So if you run
options(warn = 2)
then run your code, R will throw an error. At which point, you could run
traceback()
to see the call stack. Here is an example.
> options(warn = 2)
> foo <- function(x) bar(x + 2)
> bar <- function(y) warning("don't want to use 'y'!")
> foo(1)
Error in bar(x + 2) : (converted from warning) don't want to use 'y'!
> traceback()
7: doWithOneRestart(return(expr), restart)
6: withOneRestart(expr, restarts[[1L]])
5: withRestarts({
.Internal(.signalCondition(simpleWarning(msg, call), msg,
call))
.Internal(.dfltWarn(msg, call))
}, muffleWarning = function() NULL)
4: .signalSimpleWarning("don't want to use 'y'!", quote(bar(x +
2)))
3: warning("don't want to use 'y'!")
2: bar(x + 2)
1: foo(1)
Here you can ignore the frames marked 4: and higher. We see that foo called bar and that bar generated the warning. That should show you which functions were calling glm.fit.
If you now want to debug this, we can turn to another option to tell R to enter the debugger when it encounters an error, and as we have made warnings errors we will get a debugger when the original warning is triggered. For that you should run:
options(error = recover)
Here is an example:
> options(error = recover)
> foo(1)
Error in bar(x + 2) : (converted from warning) don't want to use 'y'!
Enter a frame number, or 0 to exit
1: foo(1)
2: bar(x + 2)
3: warning("don't want to use 'y'!")
4: .signalSimpleWarning("don't want to use 'y'!", quote(bar(x + 2)))
5: withRestarts({
6: withOneRestart(expr, restarts[[1]])
7: doWithOneRestart(return(expr), restart)
Selection:
You can then step into any of those frames to see what was happening when the warning was thrown.
To reset the above options to their default, enter
options(error = NULL, warn = 0)
As for the specific warning you quote, it is highly likely that you need to allow more iterations in the code. Once you've found out what is calling glm.fit, work out how to pass it the control argument using glm.control - see ?glm.control.
So browser(), traceback() and debug() walk into a bar, but trace() waits outside and keeps the motor running.
By inserting browser somewhere in your function, the execution will halt and wait for your input. You can move forward using n (or Enter), run the entire chunk (iteration) with c, finish the current loop/function with f, or quit with Q; see ?browser.
With debug, you get the same effect as with browser, but this stops the execution of a function at its beginning. Same shortcuts apply. This function will be in a "debug" mode until you turn it off using undebug (that is, after debug(foo), running the function foo will enter "debug" mode every time until you run undebug(foo)).
A more transient alternative is debugonce, which will remove the "debug" mode from the function after the next time it's evaluated.
traceback will give you the flow of execution of functions all the way up to where something went wrong (an actual error).
You can insert code bits (i.e. custom functions) in functions using trace, for example browser. This is useful for functions from packages and you're too lazy to get the nicely folded source code.
My general strategy looks like:
Run traceback() to see look for obvious issues
Set options(warn=2) to treat warnings like errors
Set options(error=recover) to step into the call stack on error
After going through all the steps suggested here I just learned that setting .verbose = TRUE in foreach() also gives me tons of useful information. In particular foreach(.verbose=TRUE) shows exactly where an error occurs inside the foreach loop, while traceback() does not look inside the foreach loop.
Mark Bravington's debugger which is available as the package debug on CRAN is very good and pretty straight forward.
library(debug);
mtrace(myfunction);
myfunction(a,b);
#... debugging, can query objects, step, skip, run, breakpoints etc..
qqq(); # quit the debugger only
mtrace.off(); # turn off debugging
The code pops up in a highlighted Tk window so you can see what's going on and, of course you can call another mtrace() while in a different function.
HTH
I like Gavin's answer: I did not know about options(error = recover). I also like to use the 'debug' package that gives a visual way to step through your code.
require(debug)
mtrace(foo)
foo(1)
At this point it opens up a separate debug window showing your function, with a yellow line showing where you are in the code. In the main window the code enters debug mode, and you can keep hitting enter to step through the code (and there are other commands as well), and examine variable values, etc. The yellow line in the debug window keeps moving to show where you are in the code. When done with debugging, you can turn off tracing with:
mtrace.off()
Based on the answer I received here, you should definitely check out the options(error=recover) setting. When this is set, upon encountering an error, you'll see text on the console similar to the following (traceback output):
> source(<my filename>)
Error in plot.window(...) : need finite 'xlim' values
In addition: Warning messages:
1: In xy.coords(x, y, xlabel, ylabel, log) : NAs introduced by coercion
2: In min(x) : no non-missing arguments to min; returning Inf
3: In max(x) : no non-missing arguments to max; returning -Inf
Enter a frame number, or 0 to exit
1: source(<my filename>)
2: eval.with.vis(ei, envir)
3: eval.with.vis(expr, envir, enclos)
4: LinearParamSearch(data = dataset, y = data.frame(LGD = dataset$LGD10), data.names = data
5: LinearParamSearch.R#66: plot(x = x, y = y.data, xlab = names(y), ylab = data.names[i])
6: LinearParamSearch.R#66: plot.default(x = x, y = y.data, xlab = names(y), ylab = data.nam
7: LinearParamSearch.R#66: localWindow(xlim, ylim, log, asp, ...)
8: LinearParamSearch.R#66: plot.window(...)
Selection:
At which point you can choose which "frame" to enter. When you make a selection, you'll be placed into browser() mode:
Selection: 4
Called from: stop(gettextf("replacement has %d rows, data has %d", N, n),
domain = NA)
Browse[1]>
And you can examine the environment as it was at the time of the error. When you're done, type c to bring you back to the frame selection menu. When you're done, as it tells you, type 0 to exit.
I gave this answer to a more recent question, but am adding it here for completeness.
Personally I tend not to use functions to debug. I often find that this causes as much trouble as it solves. Also, coming from a Matlab background I like being able to do this in an integrated development environment (IDE) rather than doing this in the code. Using an IDE keeps your code clean and simple.
For R, I use an IDE called "RStudio" (http://www.rstudio.com), which is available for windows, mac, and linux and is pretty easy to use.
Versions of Rstudio since about October 2013 (0.98ish?) have the capability to add breakpoints in scripts and functions: to do this, just click on the left margin of the file to add a breakpoint. You can set a breakpoint and then step through from that point on. You also have access to all of the data in that environment, so you can try out commands.
See http://www.rstudio.com/ide/docs/debugging/overview for details. If you already have Rstudio installed, you may need to upgrade - this is a relatively new (late 2013) feature.
You may also find other IDEs that have similar functionality.
Admittedly, if it's a built-in function you may have to resort to some of the suggestions made by other people in this discussion. But, if it's your own code that needs fixing, an IDE-based solution might be just what you need.
To debug Reference Class methods without instance reference
ClassName$trace(methodName, browser)
I am beginning to think that not printing error line number - a most basic requirement - BY DEFAILT- is some kind of a joke in R/Rstudio. The only reliable method I have found to find where an error occurred is to make the additional effort of calloing traceback() and see the top line.

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