MDAnalysis testsuite

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  • License: GNU Lesser General Public License v3 or later (LGPLv3+) (========================================================================== Licensing of the MDAnalys...)
  • Author: MDAnalysis
  • Maintainer: MDAnalysis
  • Requires: Python >=3.10
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Project description

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MDAnalysis is a Python toolkit to analyze molecular dynamics trajectories generated by CHARMM, Amber, NAMD, LAMMPS, or Gromacs.

The test files change less frequently, take up around 70 MB of space, and are not needed for daily use of MDAnalysis so they are distributed separately from the main package.

For installation instruction please have a look at INSTALL and the instructions online at https://userguide.mdanalysis.org/contributing_code.html

The tests are described at https://github.com/MDAnalysis/mdanalysis/wiki/UnitTests

For further information please see the documentation for MDAnalysis itself and the UserGuide: Contributing.

Contact

Please report bugs and feature requests through the Issue Tracker.

Help is also available through GitHub Discussions at https://github.com/MDAnalysis/mdanalysis/discussions/categories/installation.

For questions and discussions for code development, use GitHub Discussions.

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Avatar for IAlibay from gravatar.com IAlibay Avatar for lilyminium from gravatar.com lilyminium Avatar for Oliver.Beckstein from gravatar.com Oliver.Beckstein Avatar for richard.j.gowers from gravatar.com richard.j.gowers

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  • License: GNU Lesser General Public License v3 or later (LGPLv3+) (========================================================================== Licensing of the MDAnalys...)
  • Author: MDAnalysis
  • Maintainer: MDAnalysis
  • Requires: Python >=3.10
Classifiers

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This version

2.8.0

2.7.0

2.6.1

2.6.0

2.5.0

2.4.3

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2.4.1

2.4.0 yanked

Reason this release was yanked:

bad pins in associated MDAnalysis 2.4.0 release

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2.1.0

2.0.0

2.0.0b0 pre-release

1.1.1

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0.9.2

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0.8.0

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0.7.6

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