5 projects
jobflow-remote
Jobflow Remote is a Python package to run jobflow workflows on remote resources
atomate2-turbomole
The atomate2-turbomole package is a workflow package for Turbomole
turbomoleio
Turbomoleio is a python package containing a set of tools for the generation of inputs and parsing of outputs for TURBOMOLE.
qtoolkit
QToolKit is a python wrapper interfacing with job queues (e.g. PBS, SLURM, ...).
pysisso
Python interface to the SISSO (Sure Independence Screening and Sparsifying Operator) method.
