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GitHub / Marcello-Sega / pytim
a python package for the interfacial analysis of molecular simulations
JSON API: https://repos.ecosyste.ms/api/v1/hosts/GitHub/repositories/Marcello-Sega%2Fpytim
Stars: 76
Forks: 32
Open Issues: 17
License: gpl-3.0
Language: Python
Repo Size: 205 MB
Dependencies:
23
Created: about 7 years ago
Updated: 3 days ago
Last pushed: 4 days ago
Last synced: 3 days ago
Commit Stats
Commits: 536
Authors: 17
Mean commits per author: 31.53
Development Distribution Score: 0.257
More commit stats: https://commits.ecosyste.ms/hosts/GitHub/repositories/Marcello-Sega/pytim
Topics: charmm, data-analysis, gromacs, interfaces, interfacial-atoms, lammps, mdanalysis, mdtraj, molecular-dynamics, molecular-simulations, namd, openmm, python, sasa, scientific-computing, simulations, willard-chandler
Files
Dependencies
- codecov * test
- mdtraj * test
- pytest * test
- pytest-cov * test
- MDAnalysis >=2.0
- cython >=0.24.1
- numpy >=1.16.0
- scipy >=1.6.0
- MDAnalysis >=1.0.0
- PyWavelets >=0.5.2
- cython >=0.24.1
- dask >=1.1.1
- matplotlib *
- numpy >=1.16
- pytest *
- scikit-image >=0.14.2
- scipy >=1.6
- sphinx >=1.4.3
- actions/checkout v2 composite
- actions/setup-python v2 composite
- actions/checkout v2 composite
- actions/setup-python v2 composite
- pypa/gh-action-pypi-publish 27b31702a0e7fc50959f5ad993c78deac1bdfc29 composite