ccpbiosim
by CCPBioSim (Organization)
CCPBioSim is a UK based academic community for furthering biomolecular simulation software development.
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Usage Instructions
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
- Temporary
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Packages
| Name | Latest Version | Summary | Updated | License |
|---|
| aiida-amber | 2.2.0 | AiiDA plugin that wraps amber molecular dynamics executables | Mar 2, 2026 | MIT |
| aiida-gromacs | 2.2.1 | A plugin for using GROMACS with AiiDA for molecular dymanics simulations. | Mar 2, 2026 | MIT |
| codeentropy | 2.2.2 | Python package for calculating configurational entropy from molecular dynamics simulations using the multiscale cell correlation method. | May 1, 2026 | MIT |
| prepmd | 1.0 | A utility to automatically prepare structures from the PDB for molecular dynamics simulation | Apr 20, 2026 | GNU Affero General Public License v3.0 |