Splitting `con` files¶

Trajectory Splitting¶

Usage¶

To split a trajectory file:

rgpycrumbs eon con-splitter neb_final_path.con -o initial_images

This creates a directory named initial_images containing ipath_000.con, ipath_001.con, etc., along with an ipath.dat file listing their paths which feeds into EON via [1] :

[Nudged Elastic Band]
initial_path_in = ipath.dat
minimize_endpoints_for_ipath = False

API Reference¶

For developer details and source code see rgpycrumbs.eon.con_splitter.