Yaff is yet another force-field code

Installers

Info: This package contains files in non-standard labels.

conda install

  • linux-64  v1.4.2
  • win-64  v1.4.2
  • osx-64  v1.4.2
To install this package with conda run one of the following:
conda install -c conda-forge yaff
conda install -c conda-forge/label/cf202003 yaff

Description

Yaff stands for "Yet another force field". It is a pythonic force-field code used by Toon and Louis to test-drive their new models. The original motivation to develop Yaff was to provide a good reference implementation of the force fields developed at the Center for Molecular Modeling (CMM) at Ghent University. In its current version, Yaff is general and flexible enough to handle a large variety of force field models.


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