OpenMM
High-performance molecular dynamics toolkit with GPU support.
| Category | Drug discovery & molecules |
|---|---|
| GitHub | openmm/openmm |
| First public | 2013-10-02 (source) |
| Paper | https://journals.plos.org/ploscompbiol/article?id=10.1371/journal.pcbi.1005659 |
| License | MIT/LGPL |
| Pricing | Open source |
| Tags | #molecular-dynamics |
| Last checked | 2026-10-16 |
Specs
| Task | — |
|---|---|
| Molecular representation | — |
| Open weights | — |
| GitHub stars | 2,001 |
| Interface | — |
Specs come from each project's README, paper or official page · OpenMM README. “—” means we couldn't verify it.
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