piwheels

pmx-biobb

Toolkit for free-energy calculation setup/analysis and biomolecular structure handling

Installation

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

pip3 install pmx-biobb

Dependencies

• numpy
• scipy
• matplotlib
• rdkit

Releases

Version	Released	Bookworm Python 3.11	Trixie Python 3.13	Files
5.2.2	2025-12-19
pmx_biobb-5.2.2-cp311-cp311-linux_armv6l.whl (5 MB) pmx_biobb-5.2.2-cp311-cp311-linux_armv7l.whl (5 MB) pmx_biobb-5.2.2-cp39-cp39-linux_armv6l.whl (5 MB) pmx_biobb-5.2.2-cp39-cp39-linux_armv7l.whl (5 MB) pmx_biobb-5.2.2-cp313-cp313-linux_armv7l.whl (5 MB) pmx_biobb-5.2.2-cp313-cp313-linux_armv6l.whl (5 MB)
5.2.1	2025-12-18
pmx_biobb-5.2.1-cp311-cp311-linux_armv6l.whl (5 MB) pmx_biobb-5.2.1-cp311-cp311-linux_armv7l.whl (5 MB) pmx_biobb-5.2.1-cp313-cp313-linux_armv6l.whl (5 MB) pmx_biobb-5.2.1-cp313-cp313-linux_armv7l.whl (5 MB)
5.2.0	2025-12-18
pmx_biobb-5.2.0-cp311-cp311-linux_armv6l.whl (5 MB) pmx_biobb-5.2.0-cp311-cp311-linux_armv7l.whl (5 MB)
4.1.3	2023-07-06
pmx_biobb-4.1.3-cp37-cp37m-linux_armv6l.whl (6 MB) pmx_biobb-4.1.3-cp37-cp37m-linux_armv7l.whl (6 MB) pmx_biobb-4.1.3-cp39-cp39-linux_armv6l.whl (6 MB) pmx_biobb-4.1.3-cp39-cp39-linux_armv7l.whl (6 MB) pmx_biobb-4.1.3-cp311-cp311-linux_armv6l.whl (6 MB) pmx_biobb-4.1.3-cp311-cp311-linux_armv7l.whl (6 MB)
4.1.2	2023-07-03
pmx_biobb-4.1.2-cp37-cp37m-linux_armv6l.whl (6 MB) pmx_biobb-4.1.2-cp37-cp37m-linux_armv7l.whl (6 MB) pmx_biobb-4.1.2-cp39-cp39-linux_armv6l.whl (6 MB) pmx_biobb-4.1.2-cp39-cp39-linux_armv7l.whl (6 MB)
4.0.2	2023-06-22
pmx_biobb-4.0.2-cp37-cp37m-linux_armv6l.whl (4 MB) pmx_biobb-4.0.2-cp37-cp37m-linux_armv7l.whl (4 MB) pmx_biobb-4.0.2-cp39-cp39-linux_armv6l.whl (4 MB) pmx_biobb-4.0.2-cp39-cp39-linux_armv7l.whl (4 MB)
4.0.1	2023-06-21
pmx_biobb-4.0.1-cp37-cp37m-linux_armv6l.whl (4 MB) pmx_biobb-4.0.1-cp37-cp37m-linux_armv7l.whl (4 MB) pmx_biobb-4.0.1-cp39-cp39-linux_armv6l.whl (4 MB) pmx_biobb-4.0.1-cp39-cp39-linux_armv7l.whl (4 MB) pmx_biobb-4.0.1-cp311-cp311-linux_armv6l.whl (4 MB) pmx_biobb-4.0.1-cp311-cp311-linux_armv7l.whl (4 MB)
4.0.0	2023-06-19
pmx_biobb-4.0.0-cp37-cp37m-linux_armv6l.whl (4 MB) pmx_biobb-4.0.0-cp37-cp37m-linux_armv7l.whl (4 MB) pmx_biobb-4.0.0-cp39-cp39-linux_armv6l.whl (4 MB) pmx_biobb-4.0.0-cp39-cp39-linux_armv7l.whl (4 MB) pmx_biobb-4.0.0-cp311-cp311-linux_armv6l.whl (4 MB) pmx_biobb-4.0.0-cp311-cp311-linux_armv7l.whl (4 MB)
3.0.3	2023-05-26
pmx_biobb-3.0.3-cp37-cp37m-linux_armv6l.whl (6 MB) pmx_biobb-3.0.3-cp37-cp37m-linux_armv7l.whl (6 MB) pmx_biobb-3.0.3-cp39-cp39-linux_armv6l.whl (6 MB) pmx_biobb-3.0.3-cp39-cp39-linux_armv7l.whl (6 MB) pmx_biobb-3.0.3-cp311-cp311-linux_armv6l.whl (6 MB) pmx_biobb-3.0.3-cp311-cp311-linux_armv7l.whl (6 MB)
3.0.2	2023-05-26
pmx_biobb-3.0.2-cp37-cp37m-linux_armv6l.whl (6 MB) pmx_biobb-3.0.2-cp37-cp37m-linux_armv7l.whl (6 MB) pmx_biobb-3.0.2-cp39-cp39-linux_armv6l.whl (6 MB) pmx_biobb-3.0.2-cp39-cp39-linux_armv7l.whl (6 MB)
3.0.1	2023-05-26
pmx_biobb-3.0.1-cp37-cp37m-linux_armv6l.whl (6 MB) pmx_biobb-3.0.1-cp37-cp37m-linux_armv7l.whl (6 MB) pmx_biobb-3.0.1-cp39-cp39-linux_armv6l.whl (6 MB) pmx_biobb-3.0.1-cp39-cp39-linux_armv7l.whl (6 MB) pmx_biobb-3.0.1-cp311-cp311-linux_armv6l.whl (6 MB) pmx_biobb-3.0.1-cp311-cp311-linux_armv7l.whl (6 MB)
3.0.0	2023-05-26
2.0.0	2023-04-26
pmx_biobb-2.0.0-cp37-cp37m-linux_armv6l.whl (6 MB) pmx_biobb-2.0.0-cp37-cp37m-linux_armv7l.whl (6 MB) pmx_biobb-2.0.0-cp39-cp39-linux_armv6l.whl (6 MB) pmx_biobb-2.0.0-cp39-cp39-linux_armv7l.whl (6 MB)
1.0.1	2020-09-28
pmx_biobb-1.0.1-cp37-cp37m-linux_armv6l.whl (9 MB) pmx_biobb-1.0.1-cp37-cp37m-linux_armv7l.whl (9 MB)
1.0.0	2020-09-27
pmx_biobb-1.0.0-cp37-cp37m-linux_armv6l.whl (9 MB) pmx_biobb-1.0.0-cp37-cp37m-linux_armv7l.whl (9 MB)

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