GitHub / weitse-hsu / enhanced_sampling_tutorials
A repository providing jupyter notebooks and simulation inputs that accompany the mini course Hands-on tutorials: Advanced sampling methods using GROMACS
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PURL: pkg:github/weitse-hsu/enhanced_sampling_tutorials
Stars: 20
Forks: 2
Open issues: 1
License: None
Language: Jupyter Notebook
Size: 4.93 MB
Dependencies parsed at: Pending
Created at: over 2 years ago
Updated at: about 2 months ago
Pushed at: 12 months ago
Last synced at: 23 days ago
Topics: advanced-sampling-methods, expanded-ensembles, free-energy-calculations, gromacs, metadynamics, molecular-dynamics, replica-exchange, statistical-mechanics, tutorials, umbrella-sampling