pwtools is a Python package for pre- and postprocessing of atomistic calculations, mostly targeted to Quantum Espresso, CPMD, CP2K and LAMMPS. It is almost, but not quite, entirely unlike ASE, with some tools extending numpy/scipy. It has a set of powerful parsers and data types for storing calculation data.

Loop like a pro, make parameter studies fun.

A toolkit to create, launch and monitor SLURM jobs over existing python scripts.

Utility for facilitating parallel parameter sweeps

Execute shell commands in a parallel and/or distributed way

A Parameter Sweeping Utility Library

Modeling when labs comply, evade, or split compute across jurisdictions and what drives each outcome

Run parameter sweeps and Monte Carlo dispersions over GMAT missions in parallel from Python.

Lightweight Qt desktop control panel for ANSYS Fluent/PyFluent with UDF build, TUI console, post-processing, and parameter sweep tools.

Parallel Parameter Studies framework

Teaching-oriented ODE epidemic mini-lab with SI, SIR, and SEIR models, parameter sweeps, and interpretable metrics.

Configuration-driven numerical experiment runner for harmonic measure-related research

Julia orchestrator for reproducible TEMPO/TEMPO2 workflows + pure-Julia adaptive grids

Qwen3.6-27B BF16+DFlash 13-config parameter sweep on repne/vllm:v2. Stage A (3x3 buffer/graph) + Stage B (num_speculative_tokens) + Quality (HumanEval/MBPP). 7h, 421 problems, 195 cells.

Offload a CPU-heavy MuJoCo parameter sweep to a single Azure spot VM with hard cost-safety guarantees and cloud-side self-destruct.