[gmx-users] Trajectory Smoothing

Anthony Ivetac ivetac at biop.ox.ac.uk
Tue Apr 27 16:01:02 CEST 2004


Is there the facility within Gromacs to 'smooth' a trajectory (much as
you would when viewing a trajectory in VMD)?

For example, given a XTC file, the program would take every n-th frame
and interpolate between these frames to give a smoothing effect.

Many thanks!




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