chemsift 1.1.0

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chemsift-cloud

Commands

• chemsift-cloud login --api-key <key>: Store credentials in configuration file
• chemsift-cloud submit <input-dir>: Submit input to be processed
• chemsift-cloud status <job-id>: Check status of work for a given ID
• chemsift-cloud download <job-id> <output-dir>: Download the result of the given job ID
• chemsift-cloud list: Get list of job IDs for the user

Development

This project uses Poetry for dependency management and packaging.

Bumping the version

It is possible to bump the version of the project using the poetry version command with one of the following values as an argument:

• patch
• minor
• major

Publishing to PyPI

PyPI configuration (just once)

From your PyPI account, configure a new Trusted Publisher by providing the following information:

• Specify Owner
• Specify repository name
• Specify the workflow name

Publish a new version

In order to publish a new version to PyPI, all we will need to do is create a new tag with the version number so that it looks like this:

cli-vX.X.X

Important: The version specified when creating the tag needs to match the one in pyproject.toml which is the same one that will be returned when running poetry version.