Test suite improvements #6
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… error code tests
…nvironment variables
…culations jobs to enable testing of the process parser
…quired parameter string for the ChemShell python script
…o perform the full test and determine coverage
…ng container existing python installation
…figured container's user
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Introduces the use of a docker container with a chemshell instance to perform the full test suite to improve CI and coverage reporting. Also adds tests for the plugin's base parser and error code reporting. Closes #2