diff --git a/.devcontainer/devcontainer.json b/.devcontainer/devcontainer.json new file mode 100644 index 0000000..701f354 --- /dev/null +++ b/.devcontainer/devcontainer.json @@ -0,0 +1,28 @@ +// For format details, see https://aka.ms/devcontainer.json. For config options, see the +// README at: https://github.com/devcontainers/templates/tree/main/src/python +{ + "name": "Python 3", + // Or use a Dockerfile or Docker Compose file. More info: https://containers.dev/guide/dockerfile + "image": "mcr.microsoft.com/devcontainers/python:1-3.9-bookworm", + "features": { + "ghcr.io/devcontainers-contrib/features/ruff:1": {} + }, + // Features to add to the dev container. More info: https://containers.dev/features. + // "features": {}, + // Use 'forwardPorts' to make a list of ports inside the container available locally. + // "forwardPorts": [], + // Use 'postCreateCommand' to run commands after the container is created. + "postCreateCommand": "pipx install cruft", + // Configure tool-specific properties. + "customizations": { + // Configure properties specific to VS Code. + "vscode": { + // Add the IDs of extensions you want installed when the container is created. + "extensions": [ + "charliermarsh.ruff" + ] + } + } + // Uncomment to connect as root instead. More info: https://aka.ms/dev-containers-non-root. + // "remoteUser": "root" +} diff --git a/.github/dependabot.yml b/.github/dependabot.yml new file mode 100644 index 0000000..f33a02c --- /dev/null +++ b/.github/dependabot.yml @@ -0,0 +1,12 @@ +# To get started with Dependabot version updates, you'll need to specify which +# package ecosystems to update and where the package manifests are located. +# Please see the documentation for more information: +# https://docs.github.com/github/administering-a-repository/configuration-options-for-dependency-updates +# https://containers.dev/guide/dependabot + +version: 2 +updates: + - package-ecosystem: "devcontainers" + directory: "/" + schedule: + interval: weekly diff --git a/LICENSE b/LICENSE new file mode 100644 index 0000000..261eeb9 --- /dev/null +++ b/LICENSE @@ -0,0 +1,201 @@ + Apache License + Version 2.0, January 2004 + http://www.apache.org/licenses/ + + TERMS AND CONDITIONS FOR USE, REPRODUCTION, AND DISTRIBUTION + + 1. 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We also recommend that a + file or class name and description of purpose be included on the + same "printed page" as the copyright notice for easier + identification within third-party archives. + + Copyright [yyyy] [name of copyright owner] + + Licensed under the Apache License, Version 2.0 (the "License"); + you may not use this file except in compliance with the License. + You may obtain a copy of the License at + + http://www.apache.org/licenses/LICENSE-2.0 + + Unless required by applicable law or agreed to in writing, software + distributed under the License is distributed on an "AS IS" BASIS, + WITHOUT WARRANTIES OR CONDITIONS OF ANY KIND, either express or implied. + See the License for the specific language governing permissions and + limitations under the License. diff --git a/README.md b/README.md new file mode 100644 index 0000000..fcf513e --- /dev/null +++ b/README.md @@ -0,0 +1,84 @@ +# nomad-plugin-template +A template repository for creating a repository with a NOMAD plugin package. + + +## Getting started + +1. Click on the `Use this template` button and create a new plugin repository. The form will ask you to fill out the name for the new plugin repository. + +2. In the newly created repository, start a new Github Codespace and generate the plugin structure. + +Run the following command to create a new NOMAD plugin project using cookiecutter-nomad-plugin: + +```sh +cruft create https://github.com/FAIRmat-NFDI/cookiecutter-nomad-plugin +``` + +Cookiecutter prompts you for information regarding your plugin: + +```no-highlight +full_name [John Doe]: Citizen Kane +email [john.doe@physik.hu-berlin.de]: citizen@kane.de +github_username [foo]: kane +plugin_name [foobar]: awesome-tools +module_name [awesome_tools]: awesome_tools +short_description [NOMAD example template]: An awesome plugin for NOMAD +version [0.1.0]: +Select license: +1 - MIT +2 - BSD-3 +3 - GNU GPL v3.0+ +Choose from 1, 2, 3 [1]: 2 +include_schema_package [y/n] (y): y +include_normalizer [y/n] (y): n +include_parser [y/n] (y): y +include_app [y/n] (y): n + +INFO:post_gen_project:Initializing python for package - src +.. +INFO:post_gen_project:Remove temporary folder: licenses +INFO:post_gen_project:Remove temporary folder: macros +INFO:post_gen_project:Remove temporary folder: py_sources +``` + + + + +There you go - you just created a minimal NOMAD plugin: + +> [!NOTE] +> In the above prompt, we pressed `y` for schema_package and parser, this creates a python package with two plugin entry points: one for parser and one for schema_package. + +```no-highlight +nomad-awesome-tools/ +├── LICENSE +├── README.rst +├── pyproject.toml +├── move_template_files.sh +├── src +│ └── nomad_awesome_tools +│ ├── __init__.py +| ├── schema_packages +│ | ├── __init__.py +│ | └── plugin.py +| └── parsers +│ ├── __init__.py +│ └── plugin.py +| +├── tests +│ ├── conftest.py +│ └── test_awesome.py +└── MANIFEST.in +``` + + +> [!NOTE] +> The project `nomad-awesome-tools` is created in a new directory, we have included a helper script to move all the files to the parent level of the repository. + + +```sh +sh CHANGE_TO_PLUGIN_NAME/move_template_files.sh +``` + +> [!IMPORTANT] +> The `CHANGE_TO_PLUGIN_NAME` should be substituted by the name of the plugin you've created. In the above case it'll be `sh nomad-awesome-tools/move_template_files.sh`.