mdtools
by Molecular Dynamics Tools (Organization)
Created by Charlles Abreu (github: craabreu)
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To install packages from this channel, use the channel temporarily with conda or add it to your .condarc file for configured ongoing access. Learn more
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Packages
| Name | Latest Version | Summary | Updated | License |
|---|
| cosmolayer | 0.1.0 | Differentiable COSMO-Type Activity Coefficient Layer | Apr 14, 2026 | MIT |
| cvpack | 0.13.0 | Useful Collective Variables for OpenMM | Oct 16, 2026 | MIT |
| openmm-cpp-forces | 0.2.0 | Platform-agnostic OpenMM Forces | Oct 15, 2026 | MIT |
| openmm-opes | 0.2.0 | OpenMM implementation of On-the-fly Probability Enhanced Sampling (OPES) | Oct 20, 2026 | MIT |
| openxps | 0.2.0 | Extended Phase-Space Simulations with OpenMM | Oct 14, 2026 | MIT |
| ufedmm | 0.4.0 | Unified Free Energy Dynamics with OpenMM | Oct 17, 2026 | MIT |