https://github.com/picocentauri/pycoulomb

Python Implementation for Coulomb interactions

coulomb ewald-summation physics science

Last synced: 23 Apr 2025

https://github.com/picocentauri/ewaldad-code

Auxiliary Code Repository for 'Fast and flexible range-separated models for atomistic machine learning'

Last synced: 10 Apr 2025

https://github.com/picocentauri/pythonators

Python Project

Last synced: 17 Feb 2025

https://github.com/picocentauri/sneak-bot

A short script to check if tickets for the Berlin CinStar Sneak Preview are available.

Last synced: 17 Feb 2025

https://github.com/picocentauri/linearcalculator

A frontend to calculator linear models with equisolve and rascaline

Last synced: 17 Feb 2025

https://github.com/picocentauri/pysnips

Python code snippets and little algorithms for daily work

Last synced: 17 Feb 2025

https://github.com/picocentauri/pair_descriptor

Compute and selection with pair desciptors

Last synced: 17 Feb 2025

https://github.com/picocentauri/plode-code

Auxiliary Code Repository for 'Physics-inspired Equivariant Descriptors of Non-bonded Interactions'

Last synced: 14 May 2025

https://github.com/picocentauri/gmx_power_usage

Estimate power usage of your GROMACS MD simulation

Last synced: 14 May 2025

https://github.com/picocentauri/cavitation

Auxiliary Code Repository for 'Water cavitation results from the kinetic competition of bulk, surface and surface-defect nucleation events'

Last synced: 14 May 2025

https://github.com/picocentauri/comment-artifact

GitHub Actions for updating PR description with a link to download an artifact

artifacts comments-widget download github-actions

Last synced: 14 May 2025

https://github.com/picocentauri/actiontests

Repository for testing and debugging Github actions

Last synced: 14 May 2025

https://github.com/picocentauri/picocentauri

Last synced: 17 Feb 2025