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conda-forge.org : mdanalysis : 0.20.1
MDAnalysis is a Python library to analyze trajectories from molecular dynamics (MD) simulations. It can read and write most popular formats, and provides a flexible and fast framework for writing custom analysis through making the underlying data easily available as NumPy arrays.
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purl: pkg:conda/[email protected]
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Dependencies
- biopython
- griddataformats >=0.4.0
- gsd
- joblib
- libgcc-ng >=7.3.0
- libstdcxx-ng >=7.3.0
- matplotlib
- mmtf-python
- netcdf4
- networkx
- numpy >=1.16.4,<2.0a0
- python >=2.7,<2.8.0a0
- scikit-learn
- scipy
- seaborn
- six