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nf-core/hlatyping Usage

General Nextflow info

Nextflow handles job submissions on SLURM or other environments, and supervises running the jobs. Thus the Nextflow process must run until the pipeline is finished. We recommend that you put the process running in the background through screen / tmux or similar tool. Alternatively you can run nextflow within a cluster job submitted your job scheduler.

It is recommended to limit the Nextflow Java virtual machines memory. We recommend adding the following line to your environment (typically in ~/.bashrc or ~./bash_profile):

NXF_OPTS='-Xms1g -Xmx4g'

Running the pipeline

The typical command for running the pipeline is as follows:

nextflow run nf-core/hlatyping --reads '*_R{1,2}.fastq.gz' -profile docker

This will launch the pipeline with the docker configuration profile. See below for more information about profiles.

Note that the pipeline will create the following files in your working directory:

work            # Directory containing the nextflow working files
results         # Finished results (configurable, see below)
.nextflow_log   # Log file from Nextflow
# Other nextflow hidden files, eg. history of pipeline runs and old logs.

Updating the pipeline

When you run the above command, Nextflow automatically pulls the pipeline code from GitHub and stores it as a cached version. When running the pipeline after this, it will always use the cached version if available - even if the pipeline has been updated since. To make sure that you're running the latest version of the pipeline, make sure that you regularly update the cached version of the pipeline:

nextflow pull nf-core/hlatyping

or run it with:

nextflow run -latest nf-core/hlatyping

Reproducibility

It's a good idea to specify a pipeline version when running the pipeline on your data. This ensures that a specific version of the pipeline code and software are used when you run your pipeline. If you keep using the same tag, you'll be running the same version of the pipeline, even if there have been changes to the code since.

First, go to the nf-core/hlatyping releases page and find the latest version number - numeric only (eg. 1.0.0). Then specify this when running the pipeline with -r (one hyphen) - eg. -r 1.0.0. An example run command could look like this:

nextflow run -r 1.0.0 nf-core/hlatyping -profile docker,test

This version number will be logged in reports when you run the pipeline, so that you'll know what you used when you look back in the future.

Main Arguments

-profile

Use this parameter to choose a configuration profile. Each profile is designed for a different compute environment - follow the links below to see instructions for running on that system. Available profiles are:

  • docker
    • A generic configuration profile to be used with Docker
    • Runs using the local executor and pulls software from dockerhub: nfcore/hlatyping
  • singularity
    • A generic configuration profile to be used with Singularity
    • Runs using the local executor and pulls software from Singularity Hub: nf-core/hlatyping
  • aws
    • A starter configuration for running the pipeline on Amazon Web Services. Uses docker and Spark.
    • See docs/configuration/aws.md
  • standard
    • The default profile, used if -profile is not specified at all. Runs locally and expects all software to be installed and available on the PATH.
    • This profile is mainly designed to be used as a starting point for other configurations and is inherited by most of the other profiles.
  • none
    • No configuration at all. Useful if you want to build your own config from scratch and want to avoid loading in the default base config profile (not recommended).

--reads

Use this to specify the location of your input FastQ files. For example:

--reads 'path/to/data/sample_*_{1,2}.fastq'

Please note the following requirements:

  1. The path must be enclosed in quotes
  2. The path must have at least one * wildcard character
  3. When using the pipeline with paired end data, the path must use {1,2} notation to specify read pairs.

If left unspecified, a default pattern is used: data/*{1,2}.fastq.gz

--singleEnd

By default, the pipeline expects paired-end data. If you have single-end data, you need to specify --singleEnd on the command line when you launch the pipeline. A normal glob pattern, enclosed in quotation marks, can then be used for --reads. For example:

--singleEnd --reads '*.fastq'

It is not possible to run a mixture of single-end and paired-end files in one run.

--bam

By default, the pipeline expects input data as .fastq{.gz}. You can also provide .bam files as input and combine it with the --singleEnd option, if necessary.

This will trigger the pipeline to extract the reads from the bam file and remap them against the HLA reference sequence, using the yara mapper. Indices and references are shipped with this pipeline, have a look in the ./data folder of this repository.

--seqtype

By default, the pipeline assumes DNA as sequence type. In case you are having RNA, just provide the option with --seqtype 'rna'.

--solver

By default, the pipeline uses the glpk IP solver. With this pipeline, there is also native support for the cbc solver, just pass it as argument with --solver 'cbc', and the pipeline will run OptiType using this IP solver.

If you want to use a different solver, then you have to provide it in the ./environment.yml conda cofiguration file, which is used in the container built. This requires a valid conda recipe of course, and we encourage the creation of one, if not already present on Anaconda cloud.

--enumerations

By default, the pipeline will do one enumeration (--enumerations 1). If you want OptiType to output the optimal solution and the top N-1 suboptimal solutions in the result file, specify the number of enumerations accordingly.

--beta

By default, the pipeline uses a beta value of 0.009. The constant beta weights the regularization term of the underlying integer linear program to account for homozygosity since the formulation favors heterozygous allele combinations. Beta represents the proportion of reads that need to be additionally explained by a chosen allele combination in order to choose heterzygous solutions over homzygous solutions. Evaluation of different values for beta showed the best performance with 0.009. Please refer to the original publication of OptiType (doi: 10.1093/bioinformatics/btu548) for details.

--prefix

A string prefix for the output directory used. The default String is empty.

Job Resources

Automatic resubmission

Each step in the pipeline has a default set of requirements for number of CPUs, memory and time. For most of the steps in the pipeline, if the job exits with an error code of 143 (exceeded requested resources) it will automatically resubmit with higher requests (2 x original, then 3 x original). If it still fails after three times then the pipeline is stopped.

Custom resource requests

Wherever process-specific requirements are set in the pipeline, the default value can be changed by creating a custom config file. See the files in conf for examples.

Other command line parameters

--outdir

The output directory where the results will be saved.

--email

Set this parameter to your e-mail address to get a summary e-mail with details of the run sent to you when the workflow exits. If set in your user config file (~/.nextflow/config) then you don't need to speicfy this on the command line for every run.

-name

Name for the pipeline run. If not specified, Nextflow will automatically generate a random mnemonic.

This is used in the MultiQC report (if not default) and in the summary HTML / e-mail (always).

NB: Single hyphen (core Nextflow option)

-resume

Specify this when restarting a pipeline. Nextflow will used cached results from any pipeline steps where the inputs are the same, continuing from where it got to previously.

You can also supply a run name to resume a specific run: -resume [run-name]. Use the nextflow log command to show previous run names.

NB: Single hyphen (core Nextflow option)

-c

Specify the path to a specific config file (this is a core NextFlow command).

NB: Single hyphen (core Nextflow option)

Note - you can use this to override defaults. For example, you can specify a config file using -c that contains the following:

process.$multiqc.module = []

--max_memory

Use to set a top-limit for the default memory requirement for each process. Should be a string in the format integer-unit. eg. `--max_memory '8.GB'``

--max_time

Use to set a top-limit for the default time requirement for each process. Should be a string in the format integer-unit. eg. --max_time '2.h'

--max_cpus

Use to set a top-limit for the default CPU requirement for each process. Should be a string in the format integer-unit. eg. --max_cpus 1

--plaintext_email

Set to receive plain-text e-mails instead of HTML formatted.

--sampleLevel

Used to turn of the edgeR MDS and heatmap. Set automatically when running on fewer than 3 samples.

### --multiqc_config If you would like to supply a custom config file to MultiQC, you can specify a path with --multiqc_config. This is used instead of the config file specific to the pipeline.