PyPI page
Author:
Paul Saxe
License:
BSD-3-Clause
Summary:
Analysis of molecular dynamics output for SEAMM: time-series statistics, correlation functions, Green-Kubo and Helfand transport coefficients, and trajectory readers
Latest version:
2026.10.16.1
Required dependencies:
h5py
|
numpy
|
pint
|
pymbar
|
scipy
Optional dependencies:
mdanalysis
|
pytest
|
pytest-cov
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