https://github.com/choderalab/protons
OpenMM testbed for constant-pH methodologies.
https://github.com/choderalab/protons
constant-ph openmm ph-methodologies proton python simulation
Last synced: about 16 hours ago
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OpenMM testbed for constant-pH methodologies.
- Host: GitHub
- URL: https://github.com/choderalab/protons
- Owner: choderalab
- License: mit
- Created: 2013-11-06T03:38:09.000Z (over 12 years ago)
- Default Branch: develop
- Last Pushed: 2021-09-20T20:37:23.000Z (over 4 years ago)
- Last Synced: 2025-09-10T02:31:14.304Z (5 months ago)
- Topics: constant-ph, openmm, ph-methodologies, proton, python, simulation
- Language: Python
- Homepage: http://protons.readthedocs.io/
- Size: 161 MB
- Stars: 23
- Watchers: 19
- Forks: 13
- Open Issues: 30
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Metadata Files:
- Readme: README.md
- License: LICENSE