KThorellGroup / BACTpipe

BACTpipe: An assembly and annotation pipeline for bacterial genomics
https://bactpipe.readthedocs.org
MIT License
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Include config file for large raw files? #169

Open thorellk opened 3 years ago

thorellk commented 3 years ago

I just bumped into the issue of having excessively large raw fastq files per sample which leads to that fastp times out with the current allocations in the rackham config. Since this is a quite unusual situation, I don't think it is necessary to change the default one but it would be good to have one more for "fat" datasets. What do you think?

boulund commented 3 years ago

It would be nice if we could decouple the environment specifications from the time specifications somehow. We would encounter the same issue in the gandalf config as well if we had such large input files, and it feels like it could quickly get messy if we need to keep multiple versions of each system profile.

abhi18av commented 3 years ago

Hello team,

I am not sure how the cluster environments work, but perhaps we could explore computing the time limit dynamically?

Something like (pseudocode)

time   =  20.m   *  task.attempt
thorellk commented 3 years ago

Yeah, that would be an alternative @abhi18av, if one can make some benchmark how much time it needs per 100 Mb input file or something. It should "only" be fastp, shovill and Kraken that will be affected by input file size...

boulund commented 3 years ago

I think it should be possible to implement it so it actually reads the size of the input file for the process and computes the time allocation based on that. I think that, perhaps in combination with an extension on failures, would make sense and make it more effective. The alternative that has been proposed already would unnecessarily spend core hours for users with mainly (too) large samples on failed attempts that would then be increased only after failing.

abhi18av commented 3 years ago

Hi team,

I came across this possible solution somewhere else and perhaps we could explore this here

  time { 20.m * sample.size() }
boulund commented 3 years ago

Neat. I wasn't aware of that functionality!

I guess we would need to make some simple calculation using the sample size to come up with a good multiplier for the time, perhaps also modulo some value so we don't end up with weird allocation request. There should also be a minimum size allocation as well I think :). Can you guys help me come up with something that would make sense? I'm thinking a "normal" sample would result in a time allocation of 20.m (i.e. the multiplier would be 1), but larger samples would increase in whole integer steps depending on the size of the sample file to 20.m * 2 (medium sized file), 20.m * 3 (large file) etc.

Not sure if sample.size() would work in our context, as there is no object in the FASTP process definition called sample. We might have to see if it works with path objects instead of file (i.e. reads[0].size()), or consider rewriting the process definition slightly to use file instead of path.

abhi18av commented 3 years ago

We might have to see if it works with path objects instead of file (i.e. reads[0].size())

We could rely on toFile [method](https://docs.oracle.com/en/java/javase/11/docs/api/java.base/java/nio/file/Path.html#toFile()) for a java Path object.

Though, I think it'd be best if we encapsulate this functionality into a function or a closure in Groovy.

The final solution would look something like

  time computeTime()
boulund commented 3 years ago

Would someone have time to prototype something around this?

abhi18av commented 3 years ago

I think that the function should look something like this, however I can't think of a way I can test this on my infra.

def computeTime (inputPathObject) {
    fileObject = inputPathObject.toFile()
    fileSize = fileObject.size()
    factor = fileSize % 3

    if(factor == 0) {
      return 20.m
    }

    return 20.m * factor
}

This function might need to be adapted based on the test runs.

thorellk commented 3 years ago

Hi!

Emilio presented his masters thesis today but will continue working with me over the summer :) So we’ll start to dig into this in next week!

//Kaisa

On 10 Jun 2021, at 10:25, Abhinav Sharma @.***> wrote:

I think that the function should look something like this, however I can't think of a way I can test this on my infra.

def computeTime (inputPathObject) { fileObject = inputPathObject.toFile() fileSize = fileObject.size() factor = fileSize % 3

if(factor == 0) {
  return 20.m
}

return 20.m * factor

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abhi18av commented 3 years ago

Congrats to @emilio-r ! 🎉