Model that generates the molecular representation learned by an MPNN model trained to predict atomization energy using QM9
from dlhub_sdk.client import DLHubClient
X = get_my_data() #replace this
dl = DLHubClient()
dl.run('loganw_globusid/mpnn_features', X)
from dlhub_sdk.client import DLHubClient
dl = DLHubClient()
dl.describe_servable('loganw_globusid/mpnn_features')
pip install dlhub_sdk