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💡 molecular symmetry

methods to define the symmtry of a molecule
6 repositories

Program to compute chirality indices and assess molecular symmetry

Fortran 6 Updated Jul 12, 2024

Program to determine the symmetry point group of a molecule (doesn't work with cubic groups).

Fortran 13 4 Updated May 18, 2018

molecular point group symmetry lib

C 85 36 Updated Aug 20, 2024

A python module for manipulating cartesian and internal coordinates.

Python 80 19 Updated Jun 11, 2025

calculating the symmetry of organic molecules

Python 7 Updated May 8, 2011

Find symmetry point group of molecules

Python 3 Updated Sep 7, 2020
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