piwheels

rmsd

Calculate Root-mean-square deviation (RMSD) of two molecules, using rotation, in xyz or pdb format

Installation

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

pip3 install rmsd

Dependencies

• scipy
• numpy

Releases

Version	Released	Bullseye Python 3.9	Bookworm Python 3.11	Trixie Python 3.13	Files
1.6.5	2026-01-31
rmsd-1.6.5-py3-none-any.whl (22 KB)
1.6.4	2025-01-13
rmsd-1.6.4-py3-none-any.whl (22 KB)
1.6.3	2025-01-11
rmsd-1.6.3-py3-none-any.whl (22 KB)
1.6.2	2024-12-23
rmsd-1.6.2-py3-none-any.whl (20 KB)
1.6.1	2024-11-30
rmsd-1.6.1-py3-none-any.whl (20 KB)
1.6.0	2024-11-28
rmsd-1.6.0-py3-none-any.whl (20 KB)
1.5.1	2023-01-06
rmsd-1.5.1-py3-none-any.whl (17 KB)
1.5.0	2022-12-23
rmsd-1.5.0-py3-none-any.whl (17 KB)
1.4	2020-10-31
rmsd-1.4-py3-none-any.whl (16 KB)
1.3.2	2019-01-03
rmsd-1.3.2-py3-none-any.whl (11 KB)
1.3.0	2018-11-21
rmsd-1.3.0-py3-none-any.whl (11 KB)
1.2.7	2018-05-22
rmsd-1.2.7-py3-none-any.whl (11 KB)
1.2.6	2018-02-10
rmsd-1.2.6-py3-none-any.whl (11 KB)
1.2.5	2017-05-22
rmsd-1.2.5-py3-none-any.whl (11 KB)

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