Mercurial > repos > tduigou > rrparser
changeset 5:ada9a9847d10 draft
planemo upload for repository https://github.com/brsynth/rrparser commit 2e8aa2e7c0581c7eed2074d15f7e4317ecde2ad6
author | tduigou |
---|---|
date | Mon, 01 May 2023 01:19:14 +0000 |
parents | 71ee7ebb4a67 |
children | 77845de246f9 |
files | LICENSE README.md rrparser.xml |
diffstat | 3 files changed, 4 insertions(+), 94 deletions(-) [+] |
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--- a/LICENSE Mon Apr 03 12:45:49 2023 +0000 +++ /dev/null Thu Jan 01 00:00:00 1970 +0000 @@ -1,22 +0,0 @@ -MIT License - -Copyright (c) 2020 Jean-Loup Faulon's group & INRA -Copyright (c) 2020 University of Evry / Paris-Saclay - -Permission is hereby granted, free of charge, to any person obtaining a copy -of this software and associated documentation files (the "Software"), to deal -in the Software without restriction, including without limitation the rights -to use, copy, modify, merge, publish, distribute, sublicense, and/or sell -copies of the Software, and to permit persons to whom the Software is -furnished to do so, subject to the following conditions: - -The above copyright notice and this permission notice shall be included in all -copies or substantial portions of the Software. - -THE SOFTWARE IS PROVIDED "AS IS", WITHOUT WARRANTY OF ANY KIND, EXPRESS OR -IMPLIED, INCLUDING BUT NOT LIMITED TO THE WARRANTIES OF MERCHANTABILITY, -FITNESS FOR A PARTICULAR PURPOSE AND NONINFRINGEMENT. IN NO EVENT SHALL THE -AUTHORS OR COPYRIGHT HOLDERS BE LIABLE FOR ANY CLAIM, DAMAGES OR OTHER -LIABILITY, WHETHER IN AN ACTION OF CONTRACT, TORT OR OTHERWISE, ARISING FROM, -OUT OF OR IN CONNECTION WITH THE SOFTWARE OR THE USE OR OTHER DEALINGS IN THE -SOFTWARE.
--- a/README.md Mon Apr 03 12:45:49 2023 +0000 +++ /dev/null Thu Jan 01 00:00:00 1970 +0000 @@ -1,71 +0,0 @@ -# RRulesParser Galaxy wrapper - -The open-source software package RRulesParser is available here : https://github.com/brsynth/RRParser - -## Installing - -* Create a new section in the Galaxy config file `config/tool_conf.xml` and paste the following: -``` -<section id="sbc-rs" name="SynBioCAD RetroSynthesis"> - <tool file="synbiocad-galaxy-wrappers/RRulesParser/wrap.xml" /> -</section> -``` - -* Make sure that the following entry exists under Galaxy's destination tag in `config/job_conf.xml`: -``` -<destination id="local" runner="local" /> -``` - -And that the destination of the tool is referred under the tools tag in `config/job_conf.xml`: - -``` -<tool id="RRulesParser" destination="local" /> -``` - -## How to run RRulesParser wrapper tests - -In order to execute tests on RRulesParser wrapper, you need to: - - - Connect to your galaxy instance in interactive mode: - - ```bash - docker exec -it -u root galaxy_galaxy_1 bash - ``` - - Copy all the contents of `test-data` folder into your own test-data directory which is located in your local galaxy instance : `/galaxy/test-data`. It contains all the input files and expected output files needed for the tests. - - - Install Planemo: - You can see here the documentation for Planemo Installation : https://planemo.readthedocs.io/en/latest/installation.html - Note that they recommand to install Planemo by setting up a virtual environment: - - ```bash - python3 -m venv planemo - . planemo/bin/activate - pip install -U planemo - ``` - - Upgrade pip if needed. - - - run the tests: - - ```bash - planemo test --conda_channels conda-forge tools/synbiocad-galaxy-wrappers/RRulesParser/wrap.xml --biocontainers --no_conda_auto_init - ``` - - IMPORTANT: Maybe you will need to remove CONDA from your PATH for the command `planemo test` to run correctly. To do that, you can edit this file `~/.bashrc`, comment this line `PATH="/root/anaconda3/bin:$PATH"` and save changes. - - Planemo will output an html test summary `tool_test_output.html`. - -## Built With - -* [Galaxy](https://galaxyproject.org) - The Galaxy project - - -## Authors - -* Melchior du Lac -* Joan Hérisson -* Thomas Duigou - -## License - -This project is licensed under the MIT License - see the [LICENSE.md](LICENSE.md) file for details
--- a/rrparser.xml Mon Apr 03 12:45:49 2023 +0000 +++ b/rrparser.xml Mon May 01 01:19:14 2023 +0000 @@ -38,6 +38,9 @@ <option value="all">RetroRules (all)</option> <option value="rules-file">Other reaction rules...</option> </param> + <when value="retro"/> + <when value="forward"/> + <when value="all"/> <when value="rules-file"> <param name="file" type="data" format="csv" optional="False" label="Rules File" help="Filename of reaction rules"/> <param name="input_format" type="select" optional="False" label="File format" help="Input file format (default: csv)"> @@ -109,6 +112,6 @@ <organization name="BioRetroSynth" url="https://github.com/brsynth"/> </creator> <citations> - <citation type="doi">10.1093/nar/gky940 </citation> + <citation type="doi">10.1093/nar/gky940</citation> </citations> </tool>