nf-core_modules/README.md
2020-08-06 12:12:40 +01:00

10 KiB

nf-core/modules

DSL2 IS AN EXPERIMENTAL FEATURE UNDER DEVELOPMENT. SYNTAX, ORGANISATION AND LAYOUT OF THIS REPOSITORY MAY CHANGE IN THE NEAR FUTURE!

A repository for hosting Nextflow DSL2 module files containing tool-specific process definitions and their associated documentation.

Table of contents

Terminology

The features offered by Nextflow DSL2 can be used in various ways depending on the granularity with which you would like to write pipelines. Please see the listing below for the hierarchy and associated terminology we have decided to use when referring to DSL 2 components:

  • Module: A process that can be used within different pipelines and is as atomic as possible i.e. cannot be split into another module. An example of this would be a module file containing the process definition for a single tool such as FastQC. At present, this repository has been created to only host atomic module files that should be added to the software/ directory along with the required documentation and tests.
  • Sub-workflow: A chain of multiple modules that offer a higher-level of functionality within the context of a pipeline. For example, a sub-workflow to run multiple QC tools with FastQ files as input. Sub-workflows should be shipped with the pipeline implementation and if required they should be shared amongst different pipelines directly from there. As it stands, this repository will not host sub-workflows although this may change in the future since well-written sub-workflows will be the most powerful aspect of DSL2.
  • Workflow: What DSL1 users would consider an end-to-end pipeline. For example, from one or more inputs to a series of outputs. This can either be implemented using a large monolithic script as with DSL1, or by using a combination of DSL2 individual modules and sub-workflows.

Using existing modules

We have written a helper command in the nf-core/tools package that allows you to install any module present in the software/ directory of this repository.

  1. Install the latest version of nf-core/tools (>=1.10.2)

  2. List the available modules

    $ nf-core modules list
    
                                              ,--./,-.
              ___     __   __   __   ___     /,-._.--~\
        |\ | |__  __ /  ` /  \ |__) |__         }  {
        | \| |       \__, \__/ |  \ |___     \`-._,-`-,
                                              `._,._,'
    
        nf-core/tools version 1.10.2
    
    
    
    INFO      Modules available from nf-core/modules (master):                                                                                                                  modules.py:51
    
    bwa/index
    bwa/mem
    deeptools/computematrix
    deeptools/plotfingerprint
    deeptools/plotheatmap
    deeptools/plotprofile
    fastqc
    ..truncated..
    

Configuration and parameters

The module files hosted in this repository define a set of processes for software tools such as fastqc, trimgalore, bwa etc. This allows you to share and add common functionality across multiple pipelines in a modular fashion.

The definition and standards for module files are still under discussion amongst the community but hopefully, a description should be added here soon!

Offline usage

If you want to use an existing module file available in nf-core/modules, and you're running on a system that has no internet connection, you'll need to download the repository (e.g. git clone https://github.com/nf-core/modules.git) and place it in a location that is visible to the file system on which you are running the pipeline. Then run the pipeline by creating a custom config file called e.g. custom_module.conf containing the following information:

include /path/to/downloaded/modules/directory/

Then you can run the pipeline by directly passing the additional config file with the -c parameter:

nextflow run /path/to/pipeline/ -c /path/to/custom_module.conf

Note that the nf-core/tools helper package has a download command to download all required pipeline files + singularity containers + institutional configs + modules in one go for you, to make this process easier.

Adding a new module file

If you decide to upload your module file to nf-core/modules then this will ensure that it will be automatically downloaded, and available at run-time to all nf-core pipelines, and to everyone within the Nextflow community! See nf-core/modules/software for examples.

The definition and standards for module files are still under discussion amongst the community. Currently the following points have been agreed on:

The key words "MUST", "MUST NOT", "SHOULD", etc. are to be interpreted as described in RFC 2119.

Defining inputs, outputs and parameters

  • A module file SHOULD only define inputs and outputs as parameters. Additionally,
    • it MUST define threads or resources where required for a particular process using task.cpus
    • it MUST be possible to pass additional parameters to the tool as a command line string via the params.<MODULE>_args parameter.
    • it MUST be possible to pass additional parameters as a nextflow Map through an additional input channel val(options) [Details require discussion].
    • All NGS modules MUST accept a triplet [name, single_end, reads] as input. The single-end boolean values MUST be specified through the input channel and not inferred from the data e.g. here.
  • Process names MUST be all uppercase.
  • Each process MUST emit a file <TOOL>.version.txt containing a single line with the software's version in the format v<VERSION_NUMBER>.
  • All outputs MUST be named using emit.
  • A Process MUST NOT contain a when statement.
  • Optional inputs need development on the nextflow side. In the meanwhile, "fake files" MAY be used to work around this issue.

Atomicity

  • Software that can be piped together SHOULD be added to separate module files unless there is an run-time, storage advantage in implementing in this way e.g. bwa mem | samtools view -C -T ref.fasta to output CRAM instead of SAM.

Resource requirements

  • Each module MUST define a label process_low, process_medium or process_high to declare resource requirements. (These flags will be ignored outside of nf-core and the pipeline developer is free to define adequate resource requirements)

Publishing results

  • The module MUST accept the parameters params.out_dir and params.publish_dir and MUST publish results into ${params.out_dir}/${params.publish_dir}.

  • The publishDirMode MUST be configurable via params.publish_dir_mode

  • The module MUST accept a parameter params.publish_results accepting at least

    • "none", to publish no files at all,
    • a glob pattern which is initalized to a sensible default value.

    It MAY accept "logs" to publish relevant log files, or other flags, if applicable.

  • To ensure consistent naming, files SHOULD be renamed according to the $name variable before returning them.

Testing

  • Every module MUST be tested by adding a test workflow with a toy dataset.
  • Test data MUST be stored within this repo. It is RECOMMENDED to re-use generic files from tests/data by symlinking them into the test directory of the module. Specific files MUST be added to the test-directory directly. Test files MUST be kept as tiny as possible.

Software requirements

  • Software requirements SHOULD be declared in a conda environment.yml file, including exact version numbers. Additionally, there MUST be a Dockerfile that containerizes the environment, or packages the software if conda is not available.
  • Docker containers MUST BE identified by their sha256(Dockerfile + environment.yml).
  • Each module must have it's own Dockerfile and environment.yml file
    • Care should be taken to maintain identical files for subcommands that use the same software. Then the hash tag will be the same and they will be implicitly re-used across subcommands.

File formats

  • Wherever possible, CRAM files SHOULD be used over BAM files.
  • Wherever possible, FASTQ files SHOULD be compressed using gzip.

Documentation

  • A module MUST be documented in the meta.yml file. It MUST document params, input and output. input and output MUST be a nested list. [Exact detail need to be elaborated. ]

Uploading to nf-core/modules

Fork the nf-core/modules repository to your own GitHub account. Within the local clone of your fork add the module file to the nf-core/modules/software directory. Please keep the naming consistent between the module and documentation files e.g. bwa.nf and bwa.md, respectively.

Commit and push these changes to your local clone on GitHub, and then create a pull request on nf-core/modules GitHub repo with the appropriate information.

We will be notified automatically when you have created your pull request, and providing that everything adheres to nf-core guidelines we will endeavour to approve your pull request as soon as possible.

Help

If you have any questions or issues please send us a message on Slack.