piwheels

calorine

A Python library for building and sampling NEP models via the GPUMD package

Installation

In a virtualenv (see these instructions if you need to create one):

sudo apt install libgcc-s1 libstdc++6 libc6
pip3 install calorine

Dependencies

• ase
• matplotlib
• scikit-learn
• numpy
• pandas

Releases

Version	Released	Bullseye Python 3.9	Bookworm Python 3.11	Trixie Python 3.13	Files
3.2	2025-08-27
calorine-3.2-cp313-cp313-linux_armv6l.whl (2 MB) calorine-3.2-cp313-cp313-linux_armv7l.whl (2 MB)
3.1	2025-05-23
calorine-3.1-cp311-cp311-linux_armv6l.whl (2 MB) calorine-3.1-cp311-cp311-linux_armv7l.whl (2 MB)
3.0	2024-10-25
calorine-3.0-cp311-cp311-linux_armv6l.whl (2 MB) calorine-3.0-cp311-cp311-linux_armv7l.whl (2 MB) calorine-3.0-cp39-cp39-linux_armv6l.whl (2 MB) calorine-3.0-cp39-cp39-linux_armv7l.whl (2 MB)
2.3.1	2024-07-26
calorine-2.3.1-cp311-cp311-linux_armv6l.whl (2 MB) calorine-2.3.1-cp311-cp311-linux_armv7l.whl (2 MB) calorine-2.3.1-cp39-cp39-linux_armv6l.whl (2 MB) calorine-2.3.1-cp39-cp39-linux_armv7l.whl (2 MB)
2.3	2024-06-10
calorine-2.3-cp311-cp311-linux_armv6l.whl (2 MB) calorine-2.3-cp311-cp311-linux_armv7l.whl (2 MB) calorine-2.3-cp39-cp39-linux_armv6l.whl (2 MB) calorine-2.3-cp39-cp39-linux_armv7l.whl (2 MB) calorine-2.3-cp313-cp313-linux_armv6l.whl (2 MB) calorine-2.3-cp313-cp313-linux_armv7l.whl (2 MB)
2.2.1	2024-02-28
calorine-2.2.1-cp311-cp311-linux_armv6l.whl (2 MB) calorine-2.2.1-cp311-cp311-linux_armv7l.whl (2 MB) calorine-2.2.1-cp39-cp39-linux_armv6l.whl (2 MB) calorine-2.2.1-cp39-cp39-linux_armv7l.whl (2 MB)
2.2	2024-02-21
2.1	2023-12-27
calorine-2.1-cp311-cp311-linux_armv6l.whl (2 MB) calorine-2.1-cp311-cp311-linux_armv7l.whl (2 MB) calorine-2.1-cp39-cp39-linux_armv6l.whl (2 MB) calorine-2.1-cp39-cp39-linux_armv7l.whl (2 MB)
2.0	2023-09-15
calorine-2.0-cp39-cp39-linux_armv6l.whl (2 MB) calorine-2.0-cp39-cp39-linux_armv7l.whl (2 MB)
1.7	2023-05-10
1.6	2023-04-21
calorine-1.6-cp39-cp39-linux_armv6l.whl (1 MB) calorine-1.6-cp39-cp39-linux_armv7l.whl (1 MB)
1.5	2023-03-13
calorine-1.5-cp39-cp39-linux_armv6l.whl (1 MB) calorine-1.5-cp39-cp39-linux_armv7l.whl (1 MB)
1.4	2023-02-01
calorine-1.4-cp39-cp39-linux_armv6l.whl (1 MB) calorine-1.4-cp39-cp39-linux_armv7l.whl (1 MB)
1.3	2022-10-19
1.2	2022-09-20
1.1	2022-06-25
calorine-1.1-cp37-cp37m-linux_armv6l.whl (534 KB) calorine-1.1-cp37-cp37m-linux_armv7l.whl (534 KB) calorine-1.1-cp39-cp39-linux_armv6l.whl (1 MB) calorine-1.1-cp39-cp39-linux_armv7l.whl (1 MB)
1.0	2022-05-20
calorine-1.0-cp37-cp37m-linux_armv6l.whl (469 KB) calorine-1.0-cp37-cp37m-linux_armv7l.whl (469 KB) calorine-1.0-cp39-cp39-linux_armv6l.whl (968 KB) calorine-1.0-cp39-cp39-linux_armv7l.whl (968 KB)

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