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MD-Studio / cerise-mdstudio-das5

A specialisation of cerise for MDStudio and DAS5
Apache License 2.0
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energy output not it remote #6

Closed felipeZ closed 6 years ago

felipeZ commented 6 years ago

The energy output was added in (https://github.com/MD-Studio/cerise-mdstudio-das5/commit/5392d104974f0678c4ee13eda65a66360461f4c2) and also in the md_workflow.cwl But the calculation fails because there was not energy output generated. The problem is that in the remote ~/.cerise/api/steps/mdstudio/gromit.cwl there is not reference to energy.

I removed both the remote ~/.cerise folder and the docker instance and restart everything, but still the reference to the energy does not appear in the gromit.cwl file.

felipeZ commented 6 years ago

I just deleted the image and pulled it from dockerhub and it works!