| Name | Version | Summary | date |
| polyply |
1.7.0 |
None |
2024-04-27 10:36:22 |
| pygamd |
1.4.6 |
Python GPU-Accelerated Molecular Dynamics Software |
2024-04-17 12:53:34 |
| locuaz |
0.7.5.3 |
Antibody optimization protocol |
2024-04-06 23:05:09 |
| freud-analysis |
3.0.0 |
Powerful, efficient trajectory analysis in scientific Python. |
2024-02-23 14:27:48 |
| mdakit-sasa |
0.2.6 |
This kit allows the calculation of a solvent-accessible-surface area of a trajectory |
2023-12-29 20:34:29 |
| PDAnalysis |
0.0.4 |
Software for analysing deformation between protein structures. |
2023-11-20 13:02:18 |
| mdaencore |
1.0.0 |
Ensemble overlap comparison software for molecular data. |
2023-11-09 23:15:01 |
| waterdynamics |
1.0.0 |
Analysis of water dynamics in molecular dynamics trajectories and water interactions with other molecules. |
2023-10-18 19:31:21 |
| transport-analysis |
0.1.0 |
A Python package to compute and analyze transport properties. |
2023-10-08 07:52:23 |
| openmm-mdanalysis-reporter |
0.1 |
MDAnalysis based reporter for OpenMM |
2023-05-25 21:24:16 |
| pdb2pqr |
3.6.1 |
Automates many of the common tasks of preparing structures for continuum solvation calculations as well as many other types of biomolecular structure modeling, analysis, and simulation. |
2023-03-12 21:05:49 |