https://github.com/choderalab/saltswap
Package to fluctuate the number of counterions in an OpenMM simulation
https://github.com/choderalab/saltswap
cations chemical-potential openmm osmostat reservoir salt salt-concentration simulation water
Last synced: 4 days ago
JSON representation
Package to fluctuate the number of counterions in an OpenMM simulation
- Host: GitHub
- URL: https://github.com/choderalab/saltswap
- Owner: choderalab
- License: mit
- Created: 2017-01-17T18:58:48.000Z (about 9 years ago)
- Default Branch: master
- Last Pushed: 2021-09-20T20:39:41.000Z (over 4 years ago)
- Last Synced: 2025-09-10T02:30:49.781Z (5 months ago)
- Topics: cations, chemical-potential, openmm, osmostat, reservoir, salt, salt-concentration, simulation, water
- Language: Jupyter Notebook
- Homepage:
- Size: 7.87 MB
- Stars: 6
- Watchers: 8
- Forks: 3
- Open Issues: 10
-
Metadata Files:
- Readme: README.md
- License: LICENSE