diff --git a/dials_data/definitions/isis_sxd_nacl_processed.yml b/dials_data/definitions/isis_sxd_nacl_processed.yml index 1491b778..2cf31d58 100644 --- a/dials_data/definitions/isis_sxd_nacl_processed.yml +++ b/dials_data/definitions/isis_sxd_nacl_processed.yml @@ -7,6 +7,12 @@ description: > with the following commands: $ dials.import "$(dials.data get -q isis_sxd_example_data)/sxd_nacl_run.nxs" $ dials.find_spots imported.expt + $ dials.index imported.expt strong.refl unit_cell=5.64,5.64,5.64,90,90,90 space_group=225 + $ dials.refine indexed.expt indexed.refl data: - - url: https://github.com/dials/data-files/raw/ac63f5790bbddf7292b45ae825daefdbe60f7858/isis_sxd_nacl_processed/imported.expt - - url: https://github.com/dials/data-files/raw/ac63f5790bbddf7292b45ae825daefdbe60f7858/isis_sxd_nacl_processed/strong.refl + - url: https://github.com/dials/data-files/raw/0f9e5fadfdc5eac0ab6b4ce5e0cad8f819ac723c/isis_sxd_nacl_processed/imported.expt + - url: https://github.com/dials/data-files/raw/0f9e5fadfdc5eac0ab6b4ce5e0cad8f819ac723c/isis_sxd_nacl_processed/strong.refl + - url: https://github.com/dials/data-files/raw/0f9e5fadfdc5eac0ab6b4ce5e0cad8f819ac723c/isis_sxd_nacl_processed/indexed.expt + - url: https://github.com/dials/data-files/raw/0f9e5fadfdc5eac0ab6b4ce5e0cad8f819ac723c/isis_sxd_nacl_processed/indexed.refl + - url: https://github.com/dials/data-files/raw/0f9e5fadfdc5eac0ab6b4ce5e0cad8f819ac723c/isis_sxd_nacl_processed/refined.expt + - url: https://github.com/dials/data-files/raw/0f9e5fadfdc5eac0ab6b4ce5e0cad8f819ac723c/isis_sxd_nacl_processed/refined.refl