Deleting landscapes from a crystal structure databaseΒΆ
The script, utilities/csp/delete_csp_landscape/delete_csp_landscape.py
may be used to delete crystal structure prediction landscapes from a
crystal structure prediction database.
When a landscape is deleted, all predictions associated with that landscape are deleted.
delete_csp_landscape.py - delete a CSP landscape from a CSP landscape database
positional arguments:
landscape_database: The URL of a landscape database server.
structure_database: A Crystal structure database (.csdsqlx).
landscape_name: The name of the landscape to delete
usage examples:
python delete_csp_landscape.py http://my.landscape.server:12345 wonder_drug.csdsqlx wonder_drug
This will delete all predictions in the wonder_drug landscape from a CSP metadata database and crystal structure database.