GitHub / wehs7661 / enhanced_sampling_tutorials
A repository providing jupyter notebooks and simulation inputs that accompany the mini course Hands-on tutorials: Advanced sampling methods using GROMACS
JSON API: http://repos.ecosyste.ms/api/v1/hosts/GitHub/repositories/wehs7661%2Fenhanced_sampling_tutorials
Stars: 11
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: 9 months ago
Pushed at: 9 months ago
Last synced at: 7 months ago
Topics: advanced-sampling-methods, expanded-ensembles, free-energy-calculations, gromacs, metadynamics, molecular-dynamics, replica-exchange, statistical-mechanics, tutorials, umbrella-sampling