Components

The initial SDK release targets the components below.

RHAPSODY

Unified AI+HPC runtime supporting services alongside tasks (extends RADICAL-Pilot). RHAPSODY orchestrates coupled AI-and-simulation ensembles across heterogeneous resources.

• Repository: https://github.com/radical-cybertools/rhapsody

• Documentation: https://rhapsody-py.readthedocs.io/

• PyPI: https://pypi.org/project/rhapsody-py/

AsyncFlow

Asynchronous workflow layer for scalable HPC pipelines.

• Repository: https://github.com/radical-cybertools/radical.asyncflow

• Documentation: https://radicalasyncflow.readthedocs.io/

• PyPI: https://pypi.org/project/radical-asyncflow/

Seekrflow

Biomolecular rate-constant estimation workflows built on SEEKR.

• Repository: https://github.com/seekrcentral/seekrflow

• Documentation: https://seekrflow.readthedocs.io/en/latest

• SEEKR documentation: https://seekr.readthedocs.io/en/latest/

QuAcc

Quantum chemistry workflow recipes for high-throughput materials science.

• Repository: https://github.com/Quantum-Accelerators/quacc

• Documentation: https://quantum-accelerators.github.io/quacc/

Rootstock

Run pre-deployed machine learned interatomic potentials on HPC clusters without managing conflicting dependencies.

• Repository: https://github.com/Garden-AI/rootstock

• Model catalog: https://garden-ai.github.io/almanac/

DeepDriveSim

Deep learning-driven Adaptive Simulations.

• Repository: https://github.com/radical-collaboration/DeepDriveSim

• Documentation: https://radical-collaboration.github.io/DeepDriveSim/