libmsym python binding

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  • License: MIT License (The MIT License (MIT) Copyright (c) 2015 Marcus Johansson Permission is hereby granted, free of ch...)
  • Author: Corin Wagen
  • Tags symmetry, molecules, chemistry
  • Requires: Python >=3.9
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Project description

pymsym

libmsym is a C library dealing with point group symmetry in molecules. pymsym is its python interface.

about

this library was originally developed by Marcus Johansson. the original library can be found here and seems unmaintained - after reaching out to the initial authors, i've decided to fork this so i can maintain it.

api

see test/test.py for a low-frills introduction to the api, or the original repo for more details. i haven't modified the api at all.

Corin Wagen, 2024

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  • License: MIT License (The MIT License (MIT) Copyright (c) 2015 Marcus Johansson Permission is hereby granted, free of ch...)
  • Author: Corin Wagen
  • Tags symmetry, molecules, chemistry
  • Requires: Python >=3.9
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0.3.4

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0.3.3

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pymsym-0.3.3-cp312-cp312-musllinux_1_1_x86_64.whl (116.0 kB view details)

Uploaded CPython 3.12 musllinux: musl 1.1+ x86-64

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Uploaded CPython 3.12 musllinux: musl 1.1+ i686

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pymsym-0.3.3-cp311-cp311-musllinux_1_1_x86_64.whl (116.0 kB view details)

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pymsym-0.3.3-cp310-cp310-musllinux_1_1_x86_64.whl (116.0 kB view details)

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