# calorine

**Repository Path**: spacecube/calorine

## Basic Information

- **Project Name**: calorine
- **Description**: No description available
- **Primary Language**: Unknown
- **License**: MPL-2.0
- **Default Branch**: master
- **Homepage**: None
- **GVP Project**: No

## Statistics

- **Stars**: 0
- **Forks**: 0
- **Created**: 2025-05-04
- **Last Updated**: 2025-05-04

## Categories & Tags

**Categories**: Uncategorized

**Tags**: None

## README

calorine
========

.. image:: https://joss.theoj.org/papers/10.21105/joss.06264/status.svg
   :target: https://doi.org/10.21105/joss.06264

**calorine** is a Python package for running and analyzing molecular dynamics (MD) simulations via `GPUMD <https://gpumd.org/>`_.
It also provides functionality for constructing and sampling neuroevolution potential (NEP) models via `GPUMD <https://gpumd.org/>`_.
The full documentation can be found at https://calorine.materialsmodeling.org/.