| Name | Version | Summary | date |
| mdsasa-bolt |
1.1.0 |
This library allows the calculation of a solvent-accessible-surface area of a trajectory |
2025-07-20 06:52:55 |
| waterdynamics |
1.2.0 |
Analysis of water dynamics in molecular dynamics trajectories and water interactions with other molecules. |
2024-11-25 18:37:13 |
| mdahole2 |
0.5.0 |
A Python interface for the HOLE suite tools to analyze an ion channel pore or transporter pathway as a function of time or arbitrary order parameters. |
2024-11-23 00:20:34 |
| pathsimanalysis |
1.2.0 |
Calculates the geometric similarity of molecular dynamics trajectories using path metrics such as the Hausdorff and Fréchet distances. |
2024-11-23 00:19:30 |
| dupin |
0.1 |
Offline and online event detection scheme for rare events in molecular simulations. |
2024-01-18 22:29:27 |
| mda-tui |
0.3.0 |
A textual user interface (TUI) for MDAnalysis |
2023-09-22 18:32:09 |