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Add MD restart support and fix config loading #271

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merged 2 commits into from
May 17, 2024
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PythonFZ
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@PythonFZ PythonFZ commented Apr 26, 2024

Import changes from zincware/IPSuite#260

  • requires new ZnTrack release

@M-R-Schaefer
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Is this the required zntrack release?
https://github.com/zincware/ZnTrack/releases/tag/v0.7.3

custom_parameters = {
"directory": self.model_directory.resolve().as_posix(),
"directory": self.model_directory.as_posix(),
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How come the resolve is not needed any more?

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Maybe it was never required?

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it was definitely required. I think it might have been for the case of manually restarting the MD from within the node directory

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Looks good. Could you write a 1-2 sentence explanation how to use the restarting functionality?

@PythonFZ PythonFZ merged commit 743056b into main May 17, 2024
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@PythonFZ PythonFZ deleted the apax-restart-resolve branch May 17, 2024 12:02
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2 participants