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GitHub / Jan8be / metadynminer.py
Python package for efficient analysis of HILLS files generated by Plumed metadynamics simulations. Inspired by the Metadynminer package for R.
JSON API: https://repos.ecosyste.ms/api/v1/hosts/GitHub/repositories/Jan8be%2Fmetadynminer.py
Stars: 9
Forks: 4
Open Issues: 0
License: gpl-3.0
Language: Python
Repo Size: 22 MB
Dependencies:
6
Created: about 1 year ago
Updated: 24 days ago
Last pushed: about 1 month ago
Last synced: about 1 month ago
Topics: analysis, metadynamics, visualisation
Files
Dependencies
- actions/checkout v2 composite
- conda-incubator/setup-miniconda v2 composite
- matplotlib >=3.5.3
- numpy >=1.21.6
- pandas >=1.3.5
- pyvista >=0.38.5