piwheels

GromacsWrapper

A Python wrapper around the GROMACS tools.

Installation

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

pip3 install gromacswrapper

Dependencies

• numpy
• numkit
• matplotlib

Releases

Version	Released	Bullseye Python 3.9	Bookworm Python 3.11	Trixie Python 3.13	Files
0.9.2	2025-07-12
gromacswrapper-0.9.2-py3-none-any.whl (183 KB)
0.9.2rc1 pre-release	2025-07-12
gromacswrapper-0.9.2rc1-py3-none-any.whl (183 KB)
0.9.1	2024-09-19
GromacsWrapper-0.9.1-py3-none-any.whl (184 KB)
0.9.1rc2 pre-release	2024-09-19
GromacsWrapper-0.9.1rc2-py3-none-any.whl (184 KB)
0.9.1rc1 pre-release	2024-09-19
GromacsWrapper-0.9.1rc1-py3-none-any.whl (184 KB)
0.9.0	2024-06-15
GromacsWrapper-0.9.0-py3-none-any.whl (184 KB)
0.8.5	2023-09-16
GromacsWrapper-0.8.5-py2.py3-none-any.whl (176 KB)
0.8.4	2023-03-13
GromacsWrapper-0.8.4-py2.py3-none-any.whl (174 KB)
0.8.3	2023-03-10
GromacsWrapper-0.8.3-py2.py3-none-any.whl (174 KB)
0.8.2	2021-09-09
GromacsWrapper-0.8.2-py2.py3-none-any.whl (164 KB)
0.8.1	2021-07-23
GromacsWrapper-0.8.1-py2.py3-none-any.whl (164 KB)
0.8.0	2019-04-30
GromacsWrapper-0.8.0-py2.py3-none-any.whl (630 KB)
0.7.0	2018-08-09
GromacsWrapper-0.7.0-py2.py3-none-any.whl (617 KB)
0.6.2	2017-03-23
GromacsWrapper-0.6.2-py3-none-any.whl (730 KB)
0.6.1	2016-09-17
GromacsWrapper-0.6.1-py3-none-any.whl (730 KB)
0.6.0	2016-09-09
GromacsWrapper-0.6.0-py3-none-any.whl (724 KB)
0.5.1	2016-06-29
0.5.0	2016-05-24
0.4.0	2015-12-16
0.3.3	2015-05-24
0.3.2	2013-08-07

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