pyqmmm.qm.orca_neb_restart

Prepares a killed ORCA NEB job for a restart by moving and renaming files.

Functions

create_delete_folder([folder_name])	Create a directory for files to be deleted if it doesn't already exist.
keep_file(filename)	Check if a file is to be kept based on its extension or name.
move_files(files[, delete_folder])	Move files to a specified folder, excluding those that are to be kept.
rename_gbw(filename)	Rename .gbw files if they start with "qmscript".