pypi.org : radical.ensemblemd.mdkernels
BAC is a tool for molecular dynamics binding affinity calculations.
Registry
- Homepage
- Documentation
- JSON
purl: pkg:pypi/radical.ensemblemd.mdkernels
Keywords:
molecular
, dynamics
, binding
, affinity
, calculations
License: MIT
Latest release: about 2 years ago
First release: over 10 years ago
Dependent repositories: 2
Downloads: 4 last month
Last synced: about 1 month ago