Bruce Moxon issues

Results 3 issues of


                                            Bruce Moxon

integrative test test_filesystem_perf_results.py::test_AttentiveFP_results fails with GPU memory error on AzureML NC6sv2 compute SKU

version 1.5.1 python 3.8.10 conda environment with python venv installation as per AMPL README.md installation instructions test_filesystem_perf_results.py fails on Azure NC6sv2 compute instance with CUDA out-of-memory error NC6s_v2 is a...

Tutorial notebook 01_Exploring_Target_Activity_ExcapeDB.ipynb errs generating a diversity plot

The cell in that notebook with code ``` dp.diversity_plots(dset_key=ifile,datastore=False,id_col='compound_id',response_col='pXC50') ``` errs as follows ... ``` Canonicalizing 597 molecules... Done Computing fingerprints... Done Computing Tanimoto distance matrix... Done --------------------------------------------------------------------------- AttributeError Traceback...

jupyter server interactive session should allow gpu and core count configuration params

## In what area(s)? /area interactive > /area ansible > /area autoscaling > /area configuration > /area cyclecloud > /area documentation > /area image > /area job-scheduling > /area monitoring...

kind/feature