LOOS 4.1.0
The Lightweight Object Oriented Structural analysis library/toolkit
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Variables | |
model_name = sys.argv[1] | |
Command line arguments. | |
traj_name = sys.argv[2] | |
selection = sys.argv[3] | |
mol = loos.createSystem(model_name) | |
traj = loos.pyloos.Trajectory(traj_name, mol, subset=selection) | |
axes = frame.principalAxes() | |
axis_with_membrane computes the cosine between the first principal axis of a selection and the Z-axis (i.e. the putative membrane normal). This is written out for a trajectory as a time series...