| Name | Version | Summary | date |
| gmxpy |
0.0.5 |
Wrapping GROMACS by Python for me |
2024-05-11 09:06:34 |
| ConservedWaterSearch |
0.4.1 |
Conserved water search is a tool for finding conserved water molecules from MD trajectories. |
2024-05-11 01:35:20 |
| atomman |
1.4.11 |
Atomistic Manipulation Toolkit |
2024-04-30 17:45:36 |
| GEMDAT |
1.2.1 |
Generalized Molecular Dynamics Analysis Tool |
2024-04-08 13:21:07 |
| lammps-step |
2024.3.22 |
A SEAMM plug-in for LAMMPS, a forcefield-based molecular dynamics code. |
2024-03-22 19:33:00 |
| free-energy-landscape |
1.0.3 |
The Free Energy Landscape Analysis tool provides a full suite for analyzing and visualizing free energy landscapes from molecular dynamics simulations. It focuses on deriving key insights from collective variable (CV) data, helping researchers deeply understand molecular systems' energetics and dynamics. |
2024-03-21 18:41:15 |