Commands
BespokeFit provides a full command line interface to its major features under
the alias openff-bespoke
. The CLI is organised into sub-commands similar to
conda
, GROMACS, git
and apt
. This CLI is self-documenting via the --help
switch which is available on any subcommand:
openff-bespoke --help
openff-bespoke executor launch --help
See the quick start guide for examples of using the CLI.