This is a containerized version of Whiteboxgis tools, that implements workflows for a number of analyses. It follows the Tool Specification for reusable research software using Docker.
This tool is not finished.
Tools using this template can be run by the toolbox-runner. That is only convenience, the tools implemented using this template are independent of any framework.
The main idea is to implement a common file structure inside container to load inputs and outputs of the tool. The template shares this structures with the R template, NodeJS template and Octave template, but can be mimiced in any container.
Each container needs at least the following structure:
/
|- in/
| |- parameters.json
|- out/
| |- ...
|- src/
| |- tool.yml
| |- run.py
parameters.json
are parameters. Whichever framework runs the container, this is how parameters are passed.tool.yml
is the tool specification. It contains metadata about the scope of the tool, the number of endpoints (functions) and their parametersrun.py
is the tool itself, or a Python script that handles the execution. It has to capture all outputs and eitherprint
them to console or create files in/out
You can build the image from within the root of this repo by
docker build -t tbr_python_tempate .
Use any tag you like. If you want to run and manage the container with toolbox-runner
they should be prefixed by tbr_
to be recognized.
Alternatively, the contained .github/workflows/docker-image.yml
will build the image for you
on new releases on Github. You need to change the target repository in the aforementioned yaml.
This template installs the json2args python package to parse the parameters in the /in/parameters.json
. This assumes that
the files are not renamed and not moved and there is actually only one tool in the container. For any other case, the environment variables
PARAM_FILE
can be used to specify a new location for the parameters.json
and TOOL_RUN
can be used to specify the tool to be executed.
The run.py
has to take care of that.
To invoke the docker container directly run something similar to:
docker run --rm -it -v /path/to/local/in:/in -v /path/to/local/out:/out -e TOOL_RUN=foobar tbr_python_template
Then, the output will be in your local out and based on your local input folder. Stdout and Stderr are also connected to the host.
With the toolbox runner, this is simplyfied:
from toolbox_runner import list_tools
tools = list_tools() # dict with tool names as keys
foobar = tools.get('foobar') # it has to be present there...
foobar.run(result_path='./', foo_int=1337, foo_string="Please change me")
The example above will create a temporary file structure to be mounted into the container and then create a .tar.gz
on termination of all
inputs, outputs, specifications and some metadata, including the image sha256 used to create the output in the current working directory.
Yeah.
- change the
tool.yml
to describe your actual tool - add any
pip install
orapt-get install
needed to the dockerfile - add additional source code to
/src
- change the
run.py
to consume parameters and data from/in
and useful output inout
- build, run, rock!