bfee2
Binding Free Energy Estimator 2
Binding Free Energy Estimator 2
To install this package, run one of the following:
Binding free energy estimator (BFEE) is a python-based software that automates absolute binding free energy calculations through either the alchemical or geometric route by molecular dynamics simulations.
Summary
Binding Free Energy Estimator 2
Last Updated
Sep 19, 2026 at 16:30
License
GPL-3.0-or-later
Supported Platforms
GitHub Repository
https://github.com/fhh2626/BFEE2/tree/devDocumentation
https://github.com/fhh2626/BFEE2