Skip to content

Cannot generate clusters with learnnrnoisy #15

Description

@fburdet

Hello,

We could successfully run SAFRAN applymax and explore the results with LinkExplorer, thanks again for your help!

Now we would like to run the non-redundant algorithms.

What we did is
run calcjacc with this config
PATH_TRAINING = Adsicore_V04.tsv
PATH_TEST = DB05419.test.tsv
PATH_VALID = valid.txt

PATH_RULES = rules/alpha-1000

WORKER_THREADS = 30

VERBOSE = 1

PATH_JACCARD = jaccard.V02

which takes quite some time, and then run learnnrnoisy with this config

PATH_TRAINING = Adsicore_V04.tsv
PATH_TEST = DB05419.test.tsv
PATH_VALID = valid.txt

PATH_JACCARD = jaccard.V02
PATH_RULES = rules/alpha-1000

PATH_OUTPUT = predictions.learnnrnoisy.V02

WORKER_THREADS = 15

PATH_CLUSTER = cluster.adsicore.V02.txt

which runs pretty quickly. Unfortunately, cluster.adsicore.V02.txt is empty.

It is to be noted that the test set only contains triplets about 1 molecule, and 54 lines, could it be that there are just no clusters found? (Adsicore_V04.tsv contains 6411664 lines)

Activity

Sign up for free to join this conversation on GitHub. Already have an account? Sign in to comment

Metadata

Metadata

Assignees

No one assigned

    Labels

    No labels
    No labels

    Type

    No type

    Projects

    No projects

      Milestone

      No milestone

      Relationships

      None yet

      Development

      No branches or pull requests

      Issue actions