10. Connect a volume series to Class3D

This notebook connects each volume from a volume series (like those produced by 3D Var Display) to a 3D Class job. This saves the user the step of downloading a large volume series file, extracting it and uploading the volumes to the server, importing them, and manually connecting them to the job.

Note

Since this script unzips the volume series itself, it must be run on a system with access to CryoSPARC’s filesystem.

from cryosparc.tools import CryoSPARC

cs = CryoSPARC(base_port=40000)
assert cs.test_connection()

Connection succeeded to CryoSPARC command_core at http://localhost:40002
Connection succeeded to CryoSPARC command_vis at http://localhost:40003
Connection succeeded to CryoSPARC command_rtp at http://localhost:40005

First, we find the correct job and determine the path to the zipped Volume Series.

project = cs.find_project("P296")
workspace = project.find_workspace("W2")
var3Ddisp_job = project.find_job("J45")

desired_volume_series = 0

series_path = var3Ddisp_job.load_output(f"series_{desired_volume_series}")["series/path"][0]
series_path = str(project.dir() / series_path)

unzip_path = series_path[:-4]
print(unzip_path)

import zipfile

with zipfile.ZipFile(series_path, "r") as z:
    z.extractall(unzip_path)

/bulk9/data/cryosparcdev_projects/rposert/CS-cb1-gpcr/J45/J45_component_000

Now we simply create and launch an Import Volumes job, pointing it at all of the .mrc files we just extracted.

lane = "cryoem9"

import_volumes_job = workspace.create_job(
    "import_volumes",
    params={"volume_blob_path": unzip_path + "/*.mrc"},
)
import_volumes_job.queue(lane)
import_volumes_job.wait_for_done()

'completed'

All that is left now is to create a 3D classification job and plug in the particles. This allows the user to plug in a desired particle stack and launch the job from the CryoSPARC interface.

no_of_frames = len(import_volumes_job.doc["output_result_groups"])
vol_outputs = [(import_volumes_job.uid, f"imported_volume_{v}") for v in range(1, no_of_frames + 1)]

new_class_3D_job = workspace.create_job(
    "class_3D",
    connections={"volume": vol_outputs},
    params={"class3D_N_K": no_of_frames, "class3D_init_mode": "input"},
)