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Article ID: 277 - Last Modified: May 9, 2011

Trying to visualize Desmond trajectory is causing Maestro crashes when I click on the "T" button next to the _desmond_scratch_donotchangeN entry. What am I doing wrong?

This behavior is caused by using Desmond → Molecular Dynamics → Import from file for loading a finished MD trajectory. This panel should be used for starting new MD simulations only, not examining the results of completed runs. To analyze the results of an MD run, load the corresponding md_desmond_job-out.cms file (which is the output of the MD job) into the Project Table via Project → Import Structures → Files of type: Desmond (*.cms, *.cmsgz, *.cms.gz).

Keywords: molecular dynamics, MD, trajectory, crash, desmond_scratch_donotchange, Maestro

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