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check_promise does not properly add the trajectories. The paths to the trajectories are appended to gromos_system by the analysis script of the simulation, but the data is not imported.
Code Example
groSys=GromosSystem(......) # create a GromosSystemgroSys.md(....) # submit some MD simulations that produce trajectories# wait for simulations to be done on cluster (and checked that they worked properly)groSys._check_promises() # should add trajectories`groSys.tre.density() # will throw error due to empty DataFrame
Bug?
Problems with trajectories or with future file or check_promise?
Help is welcomed
The text was updated successfully, but these errors were encountered:
Description
check_promise does not properly add the trajectories. The paths to the trajectories are appended to gromos_system by the analysis script of the simulation, but the data is not imported.
Code Example
Bug?
Problems with trajectories or with future file or check_promise?
Help is welcomed
The text was updated successfully, but these errors were encountered: